Home Aminos 2-(benzylamino)-1-(1-ethyl-1H-pyrazol-4-yl)ethan-1-ol

2-(benzylamino)-1-(1-ethyl-1H-pyrazol-4-yl)ethan-1-ol

CAS No.:
1798698-87-9
Catalog Number:
AG01BCX9
Molecular Formula:
C14H19N3O
Molecular Weight:
245.3202
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Product Description
Catalog Number:
AG01BCX9
Chemical Name:
2-(benzylamino)-1-(1-ethyl-1H-pyrazol-4-yl)ethan-1-ol
CAS Number:
1798698-87-9
Molecular Formula:
C14H19N3O
Molecular Weight:
245.3202
MDL Number:
MFCD28012337
IUPAC Name:
2-(benzylamino)-1-(1-ethylpyrazol-4-yl)ethanol
InChI:
InChI=1S/C14H19N3O/c1-2-17-11-13(9-16-17)14(18)10-15-8-12-6-4-3-5-7-12/h3-7,9,11,14-15,18H,2,8,10H2,1H3
InChI Key:
RTMDUWKNXQWQAN-UHFFFAOYSA-N
SMILES:
CCn1ncc(c1)C(CNCc1ccccc1)O
Properties
Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.153g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
245.326g/mol
Monoisotopic Mass:
245.153g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
50.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties