Home Other Building Blocks N-(pentan-3-yl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide hydrochloride

N-(pentan-3-yl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide hydrochloride

CAS No.:
1235438-84-2
Catalog Number:
AG01A8AK
Molecular Formula:
C14H21ClN2O2
Molecular Weight:
284.7817
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Product Description
Catalog Number:
AG01A8AK
Chemical Name:
N-(pentan-3-yl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide hydrochloride
CAS Number:
1235438-84-2
Molecular Formula:
C14H21ClN2O2
Molecular Weight:
284.7817
MDL Number:
MFCD16040012
IUPAC Name:
N-pentan-3-yl-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide;hydrochloride
InChI:
InChI=1S/C14H20N2O2.ClH/c1-3-10(4-2)16-14(17)13-9-15-11-7-5-6-8-12(11)18-13;/h5-8,10,13,15H,3-4,9H2,1-2H3,(H,16,17);1H
InChI Key:
HIEYOMFPTOQAGT-UHFFFAOYSA-N
SMILES:
CCC(NC(=O)C1CNc2c(O1)cccc2)CC.Cl
Properties
Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.129g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
284.784g/mol
Monoisotopic Mass:
284.129g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties