N-[2-(pyrrolidin-1-ylmethyl)phenyl]imidazole-1-carboxamide

C15H18N4O — CID 81257336

IUPACN-[2-(pyrrolidin-1-ylmethyl)phenyl]imidazole-1-carboxamide
SMILESO=C(Nc1ccccc1CN1CCCC1)n1ccnc1
InChIInChI=1S/C15H18N4O/c20-15(19-10-7-16-12-19)17-14-6-2-1-5-13(14)11-18-8-3-4-9-18/h1-2,5-7,10,12H,3-4,8-9,11H2,(H,17,20)
InChIKeyBOGFKVRANVGGGD-UHFFFAOYSA-N
MW270.34 g/mol
LogP2.56
Rot. Bonds3

About N-[2-(pyrrolidin-1-ylmethyl)phenyl]imidazole-1-carboxamide

N-[2-(pyrrolidin-1-ylmethyl)phenyl]imidazole-1-carboxamide (PubChem CID 81257336) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is N-[2-(pyrrolidin-1-ylmethyl)phenyl]imidazole-1-carboxamide.

Molecular Properties

Compound NameN-[2-(pyrrolidin-1-ylmethyl)phenyl]imidazole-1-carboxamide
PubChem CID81257336
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC NameN-[2-(pyrrolidin-1-ylmethyl)phenyl]imidazole-1-carboxamide
SMILESO=C(Nc1ccccc1CN1CCCC1)n1ccnc1
InChIInChI=1S/C15H18N4O/c20-15(19-10-7-16-12-19)17-14-6-2-1-5-13(14)11-18-8-3-4-9-18/h1-2,5-7,10,12H,3-4,8-9,11H2,(H,17,20)
InChIKeyBOGFKVRANVGGGD-UHFFFAOYSA-N
XLogP2.56
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-(pyrrolidin-1-ylmethyl)phenyl]imidazole-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(piperidin-1-ylmethyl)phenyl]prop-2-enamide
CID 139018823
N-(2-imidazol-1-ylphenyl)imidazole-1-carboxamide
CID 81257478
4-(2-hydroxyethyl)-N-[2-(piperidin-1-ylmethyl)phenyl]piperazine-1-carboxamide
CID 72920810
(2S)-N-[2-(piperidin-1-ylmethyl)phenyl]-2-pyridin-2-ylpyrrolidine-1-carboxamide
CID 97278774
N-[2-(methanesulfonamido)phenyl]imidazole-1-carboxamide
CID 81257028
(2R)-2-amino-4-methyl-N-[2-(pyrrolidin-1-ylmethyl)phenyl]pentanamide
CID 104902926
2-amino-2-ethyl-N-[2-(pyrrolidin-1-ylmethyl)phenyl]butanamide
CID 79814004
4,4,4-trifluoro-N-[2-(pyrrolidin-1-ylmethyl)phenyl]butanamide
CID 131911207
2-cyclopentyl-N-[2-(pyrrolidin-1-ylmethyl)phenyl]acetamide
CID 71896430
4-chloro-N-[2-(pyrrolidin-1-ylmethyl)phenyl]butanamide
CID 55204824
1-pentan-3-yl-N-[2-(pyrrolidin-1-ylmethyl)phenyl]pyrazole-3-carboxamide
CID 75385005
5-fluoro-N-[2-(pyrrolidin-1-ylmethyl)phenyl]pyridine-3-carboxamide
CID 131894722

Frequently Asked Questions

What is the IUPAC name of N-[2-(pyrrolidin-1-ylmethyl)phenyl]imidazole-1-carboxamide?
The IUPAC name of N-[2-(pyrrolidin-1-ylmethyl)phenyl]imidazole-1-carboxamide (CID 81257336) is N-[2-(pyrrolidin-1-ylmethyl)phenyl]imidazole-1-carboxamide.
What is the SMILES notation for N-[2-(pyrrolidin-1-ylmethyl)phenyl]imidazole-1-carboxamide?
The canonical SMILES for N-[2-(pyrrolidin-1-ylmethyl)phenyl]imidazole-1-carboxamide is O=C(Nc1ccccc1CN1CCCC1)n1ccnc1.
What is the InChIKey of N-[2-(pyrrolidin-1-ylmethyl)phenyl]imidazole-1-carboxamide?
The InChIKey is BOGFKVRANVGGGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c20-15(19-10-7-16-12-19)17-14-6-2-1-5-13(14)11-18-8-3-4-9-18/h1-2,5-7,10,12H,3-4,8-9,11H2,(H,17,20).
What are the key properties of N-[2-(pyrrolidin-1-ylmethyl)phenyl]imidazole-1-carboxamide?
N-[2-(pyrrolidin-1-ylmethyl)phenyl]imidazole-1-carboxamide has a molecular weight of 270.34 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(pyrrolidin-1-ylmethyl)phenyl]imidazole-1-carboxamide is sourced from PubChem (CID 81257336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).