N-[4-(1H-imidazol-2-yl)phenyl]piperidine-3-carboxamide

C15H18N4O — CID 110471952

IUPACN-[4-(1H-imidazol-2-yl)phenyl]piperidine-3-carboxamide
SMILESO=C(Nc1ccc(-c2ncc[nH]2)cc1)C1CCCNC1
InChIInChI=1S/C15H18N4O/c20-15(12-2-1-7-16-10-12)19-13-5-3-11(4-6-13)14-17-8-9-18-14/h3-6,8-9,12,16H,1-2,7,10H2,(H,17,18)(H,19,20)
InChIKeyLWOKBQZFCKJNLT-UHFFFAOYSA-N
MW270.34 g/mol
LogP2.01
Rot. Bonds3

About N-[4-(1H-imidazol-2-yl)phenyl]piperidine-3-carboxamide

N-[4-(1H-imidazol-2-yl)phenyl]piperidine-3-carboxamide (PubChem CID 110471952) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is N-[4-(1H-imidazol-2-yl)phenyl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN-[4-(1H-imidazol-2-yl)phenyl]piperidine-3-carboxamide
PubChem CID110471952
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC NameN-[4-(1H-imidazol-2-yl)phenyl]piperidine-3-carboxamide
SMILESO=C(Nc1ccc(-c2ncc[nH]2)cc1)C1CCCNC1
InChIInChI=1S/C15H18N4O/c20-15(12-2-1-7-16-10-12)19-13-5-3-11(4-6-13)14-17-8-9-18-14/h3-6,8-9,12,16H,1-2,7,10H2,(H,17,18)(H,19,20)
InChIKeyLWOKBQZFCKJNLT-UHFFFAOYSA-N
XLogP2.01
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 52.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-N-(1H-imidazol-2-yl)piperidine-3-carboxamide
CID 81139688
N-[4-(1H-pyrazol-5-yl)phenyl]piperidine-3-carboxamide
CID 43713244
2-hydroxy-N-[4-(1H-imidazol-2-yl)phenyl]cyclopentane-1-carboxamide
CID 110014390
N-[4-(1H-imidazol-2-yl)phenyl]-1-methylsulfonylpiperidine-4-carboxamide
CID 110726535
4-hydroxy-N-[4-(1H-imidazol-2-yl)phenyl]pyrrolidine-2-carboxamide
CID 119871848
N-[2-(4-fluorophenyl)-3H-benzimidazol-5-yl]piperidine-3-carboxamide;dihydrochloride
CID 119854445
N-(6-chloro-3-pyridinyl)piperidine-3-carboxamide
CID 81426071
N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]piperidine-3-carboxamide
CID 119311516
(3S)-N-[4-(dimethylamino)phenyl]piperidine-3-carboxamide
CID 28807397
(3R)-N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]piperidine-3-carboxamide
CID 81118348
N-(1H-indol-5-yl)piperidine-3-carboxamide
CID 61248015
N-[4-[5-(trifluoromethyl)-1H-pyrazol-3-yl]phenyl]piperidine-3-carboxamide
CID 167761264

Frequently Asked Questions

What is the IUPAC name of N-[4-(1H-imidazol-2-yl)phenyl]piperidine-3-carboxamide?
The IUPAC name of N-[4-(1H-imidazol-2-yl)phenyl]piperidine-3-carboxamide (CID 110471952) is N-[4-(1H-imidazol-2-yl)phenyl]piperidine-3-carboxamide.
What is the SMILES notation for N-[4-(1H-imidazol-2-yl)phenyl]piperidine-3-carboxamide?
The canonical SMILES for N-[4-(1H-imidazol-2-yl)phenyl]piperidine-3-carboxamide is O=C(Nc1ccc(-c2ncc[nH]2)cc1)C1CCCNC1.
What is the InChIKey of N-[4-(1H-imidazol-2-yl)phenyl]piperidine-3-carboxamide?
The InChIKey is LWOKBQZFCKJNLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c20-15(12-2-1-7-16-10-12)19-13-5-3-11(4-6-13)14-17-8-9-18-14/h3-6,8-9,12,16H,1-2,7,10H2,(H,17,18)(H,19,20).
What are the key properties of N-[4-(1H-imidazol-2-yl)phenyl]piperidine-3-carboxamide?
N-[4-(1H-imidazol-2-yl)phenyl]piperidine-3-carboxamide has a molecular weight of 270.34 g/mol, XLogP of 2.01, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1H-imidazol-2-yl)phenyl]piperidine-3-carboxamide is sourced from PubChem (CID 110471952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).