3-phenyl-N-(piperidin-3-ylmethyl)imidazole-4-carboxamide

C16H20N4O — CID 119464372

IUPAC3-phenyl-N-(piperidin-3-ylmethyl)imidazole-4-carboxamide
SMILESO=C(NCC1CCCNC1)c1cncn1-c1ccccc1
InChIInChI=1S/C16H20N4O/c21-16(19-10-13-5-4-8-17-9-13)15-11-18-12-20(15)14-6-2-1-3-7-14/h1-3,6-7,11-13,17H,4-5,8-10H2,(H,19,21)
InChIKeyYNAVSCFOEQJDNX-UHFFFAOYSA-N
MW284.36 g/mol
LogP1.60
Rot. Bonds4

About 3-phenyl-N-(piperidin-3-ylmethyl)imidazole-4-carboxamide

3-phenyl-N-(piperidin-3-ylmethyl)imidazole-4-carboxamide (PubChem CID 119464372) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 3-phenyl-N-(piperidin-3-ylmethyl)imidazole-4-carboxamide.

Molecular Properties

Compound Name3-phenyl-N-(piperidin-3-ylmethyl)imidazole-4-carboxamide
PubChem CID119464372
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name3-phenyl-N-(piperidin-3-ylmethyl)imidazole-4-carboxamide
SMILESO=C(NCC1CCCNC1)c1cncn1-c1ccccc1
InChIInChI=1S/C16H20N4O/c21-16(19-10-13-5-4-8-17-9-13)15-11-18-12-20(15)14-6-2-1-3-7-14/h1-3,6-7,11-13,17H,4-5,8-10H2,(H,19,21)
InChIKeyYNAVSCFOEQJDNX-UHFFFAOYSA-N
XLogP1.60
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3-hydroxycyclohexyl)methyl]-3-phenylimidazole-4-carboxamide
CID 111459853
1-(cyclopropylmethyl)-3-[(3-phenylimidazole-4-carbonyl)amino]urea
CID 71898793
N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119461032
3,5-dimethyl-1-phenyl-N-(piperidin-3-ylmethyl)pyrazole-4-carboxamide;hydrochloride
CID 119460021
1-phenyl-N-(piperidin-3-ylmethyl)triazole-4-carboxamide
CID 119461356
5-cyclopropyl-1-phenyl-N-(piperidin-3-ylmethyl)pyrazole-4-carboxamide;hydrochloride
CID 119463223
3-methyl-1-phenyl-N-(piperidin-3-ylmethyl)pyrazole-4-carboxamide;hydrochloride
CID 119462686
1-phenyl-N-(piperidin-3-ylmethyl)-3-pyridin-3-ylpyrazole-4-carboxamide;dihydrochloride
CID 119459838
N-ethyl-3-phenylimidazole-4-carboxamide
CID 47109591
2,5-dimethyl-1-phenyl-N-(piperidin-3-ylmethyl)pyrrole-3-carboxamide
CID 119459788
2-phenyl-N-[[(3R)-piperidin-3-yl]methyl]acetamide;hydrochloride
CID 166436266
N-(piperidin-3-ylmethyl)-4-pyrazol-1-ylbenzamide
CID 119461275

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-N-(piperidin-3-ylmethyl)imidazole-4-carboxamide?
The IUPAC name of 3-phenyl-N-(piperidin-3-ylmethyl)imidazole-4-carboxamide (CID 119464372) is 3-phenyl-N-(piperidin-3-ylmethyl)imidazole-4-carboxamide.
What is the SMILES notation for 3-phenyl-N-(piperidin-3-ylmethyl)imidazole-4-carboxamide?
The canonical SMILES for 3-phenyl-N-(piperidin-3-ylmethyl)imidazole-4-carboxamide is O=C(NCC1CCCNC1)c1cncn1-c1ccccc1.
What is the InChIKey of 3-phenyl-N-(piperidin-3-ylmethyl)imidazole-4-carboxamide?
The InChIKey is YNAVSCFOEQJDNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c21-16(19-10-13-5-4-8-17-9-13)15-11-18-12-20(15)14-6-2-1-3-7-14/h1-3,6-7,11-13,17H,4-5,8-10H2,(H,19,21).
What are the key properties of 3-phenyl-N-(piperidin-3-ylmethyl)imidazole-4-carboxamide?
3-phenyl-N-(piperidin-3-ylmethyl)imidazole-4-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 1.60, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-N-(piperidin-3-ylmethyl)imidazole-4-carboxamide is sourced from PubChem (CID 119464372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).