Home Aminos 4-(cyclopentylamino)-3-nitrobenzamide

4-(cyclopentylamino)-3-nitrobenzamide

CAS No.:
850022-39-8
Catalog Number:
AG01B5C8
Molecular Formula:
C12H15N3O3
Molecular Weight:
249.2658
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Product Description
Catalog Number:
AG01B5C8
Chemical Name:
4-(cyclopentylamino)-3-nitrobenzamide
CAS Number:
850022-39-8
Molecular Formula:
C12H15N3O3
Molecular Weight:
249.2658
MDL Number:
MFCD04778227
IUPAC Name:
4-(cyclopentylamino)-3-nitrobenzamide
InChI:
InChI=1S/C12H15N3O3/c13-12(16)8-5-6-10(11(7-8)15(17)18)14-9-3-1-2-4-9/h5-7,9,14H,1-4H2,(H2,13,16)
InChI Key:
XKICBDATFCLJBS-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1NC1CCCC1)C(=O)N
Properties
Complexity:
323  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.111g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
249.27g/mol
Monoisotopic Mass:
249.111g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties