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1087797-78-1 | N-[(1-ethylpyrrolidin-2-yl)methyl]-1H-imidazole-1-carboxamide
CAS No: 1087797-78-1 Catalog No: AG019QQK MDL No:MFCD11099714
Product Description
Catalog Number:
AG019QQK
Chemical Name:
N-[(1-ethylpyrrolidin-2-yl)methyl]-1H-imidazole-1-carboxamide
CAS Number:
1087797-78-1
Molecular Formula:
C11H18N4O
Molecular Weight:
222.2868
MDL Number:
MFCD11099714
IUPAC Name:
N-[(1-ethylpyrrolidin-2-yl)methyl]imidazole-1-carboxamide
InChI:
InChI=1S/C11H18N4O/c1-2-14-6-3-4-10(14)8-13-11(16)15-7-5-12-9-15/h5,7,9-10H,2-4,6,8H2,1H3,(H,13,16)
InChI Key:
UZOJRKIEBJHXSL-UHFFFAOYSA-N
SMILES:
CCN1CCCC1CNC(=O)n1cncc1
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.148g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
222.292g/mol
Monoisotopic Mass:
222.148g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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