4-(6-chloro-1H-benzimidazol-2-yl)-N-phenylpiperidine-1-carboxamide

C19H19ClN4O — CID 1429783

IUPAC4-(6-chloro-1H-benzimidazol-2-yl)-N-phenylpiperidine-1-carboxamide
SMILESO=C(Nc1ccccc1)N1CCC(c2nc3ccc(Cl)cc3[nH]2)CC1
InChIInChI=1S/C19H19ClN4O/c20-14-6-7-16-17(12-14)23-18(22-16)13-8-10-24(11-9-13)19(25)21-15-4-2-1-3-5-15/h1-7,12-13H,8-11H2,(H,21,25)(H,22,23)
InChIKeyFXIUCCJHZAKFSQ-UHFFFAOYSA-N
MW354.84 g/mol
LogP4.63
Rot. Bonds2

About 4-(6-chloro-1H-benzimidazol-2-yl)-N-phenylpiperidine-1-carboxamide

4-(6-chloro-1H-benzimidazol-2-yl)-N-phenylpiperidine-1-carboxamide (PubChem CID 1429783) has the molecular formula C19H19ClN4O and a molecular weight of 354.84 g/mol. Its IUPAC name is 4-(6-chloro-1H-benzimidazol-2-yl)-N-phenylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-(6-chloro-1H-benzimidazol-2-yl)-N-phenylpiperidine-1-carboxamide
PubChem CID1429783
Molecular FormulaC19H19ClN4O
Molecular Weight354.84 g/mol
Exact Mass354.12
IUPAC Name4-(6-chloro-1H-benzimidazol-2-yl)-N-phenylpiperidine-1-carboxamide
SMILESO=C(Nc1ccccc1)N1CCC(c2nc3ccc(Cl)cc3[nH]2)CC1
InChIInChI=1S/C19H19ClN4O/c20-14-6-7-16-17(12-14)23-18(22-16)13-8-10-24(11-9-13)19(25)21-15-4-2-1-3-5-15/h1-7,12-13H,8-11H2,(H,21,25)(H,22,23)
InChIKeyFXIUCCJHZAKFSQ-UHFFFAOYSA-N
XLogP4.63
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.84
LogP ≤ 54.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(6-chloro-1H-benzimidazol-2-yl)-N-(4-chlorophenyl)piperidine-1-carboxamide
CID 1429871
4-(6-chloro-1H-benzimidazol-2-yl)-N-(3-methoxyphenyl)piperidine-1-carboxamide
CID 43815842
4-(6-chloro-1H-benzimidazol-2-yl)-N-[2-(trifluoromethyl)phenyl]piperidine-1-carboxamide
CID 1429886
4-(1H-benzimidazol-2-yl)-N-(3-fluorophenyl)piperidine-1-carboxamide
CID 23605637
N-(4-chlorophenyl)-3-(6-methyl-1H-benzimidazol-2-yl)piperidine-1-carboxamide
CID 3223990
4-[4-(6-chloro-1H-benzimidazol-2-yl)piperidin-1-yl]-4-oxobutanoate
CID 6985710
3-(6-chloro-1H-benzimidazol-2-yl)-N-(4-chlorophenyl)piperidine-1-carbothioamide
CID 3223996
4-(1H-benzimidazol-2-yl)-N-phenylpiperidine-1-carbothioamide
CID 43815863
2-[4-(6-chloro-1H-benzimidazol-2-yl)piperidin-1-yl]-N-(4-ethoxyphenyl)acetamide
CID 1453163
4-(5,6-dimethyl-1H-benzimidazol-2-yl)-N-(4-methylsulfanylphenyl)piperidine-1-carboxamide
CID 1430645
(2S)-2-[4-(6-chloro-1H-benzimidazol-2-yl)piperidin-1-yl]-N-(2,6-dimethylphenyl)propanamide
CID 1453129
2-[4-(6-chloro-1H-benzimidazol-2-yl)piperidin-1-yl]-N-(2-methoxyphenyl)acetamide
CID 43815822

Frequently Asked Questions

What is the IUPAC name of 4-(6-chloro-1H-benzimidazol-2-yl)-N-phenylpiperidine-1-carboxamide?
The IUPAC name of 4-(6-chloro-1H-benzimidazol-2-yl)-N-phenylpiperidine-1-carboxamide (CID 1429783) is 4-(6-chloro-1H-benzimidazol-2-yl)-N-phenylpiperidine-1-carboxamide.
What is the SMILES notation for 4-(6-chloro-1H-benzimidazol-2-yl)-N-phenylpiperidine-1-carboxamide?
The canonical SMILES for 4-(6-chloro-1H-benzimidazol-2-yl)-N-phenylpiperidine-1-carboxamide is O=C(Nc1ccccc1)N1CCC(c2nc3ccc(Cl)cc3[nH]2)CC1.
What is the InChIKey of 4-(6-chloro-1H-benzimidazol-2-yl)-N-phenylpiperidine-1-carboxamide?
The InChIKey is FXIUCCJHZAKFSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN4O/c20-14-6-7-16-17(12-14)23-18(22-16)13-8-10-24(11-9-13)19(25)21-15-4-2-1-3-5-15/h1-7,12-13H,8-11H2,(H,21,25)(H,22,23).
What are the key properties of 4-(6-chloro-1H-benzimidazol-2-yl)-N-phenylpiperidine-1-carboxamide?
4-(6-chloro-1H-benzimidazol-2-yl)-N-phenylpiperidine-1-carboxamide has a molecular weight of 354.84 g/mol, XLogP of 4.63, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-chloro-1H-benzimidazol-2-yl)-N-phenylpiperidine-1-carboxamide is sourced from PubChem (CID 1429783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).