1-(1H-benzimidazol-2-yl)-N-(2,4-difluorophenyl)piperidine-4-carboxamide

C19H18F2N4O — CID 122176153

IUPAC1-(1H-benzimidazol-2-yl)-N-(2,4-difluorophenyl)piperidine-4-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)C1CCN(c2nc3ccccc3[nH]2)CC1
InChIInChI=1S/C19H18F2N4O/c20-13-5-6-15(14(21)11-13)22-18(26)12-7-9-25(10-8-12)19-23-16-3-1-2-4-17(16)24-19/h1-6,11-12H,7-10H2,(H,22,26)(H,23,24)
InChIKeyGVXKIWVRHSWMAX-UHFFFAOYSA-N
MW356.38 g/mol
LogP3.70
Rot. Bonds3

About 1-(1H-benzimidazol-2-yl)-N-(2,4-difluorophenyl)piperidine-4-carboxamide

1-(1H-benzimidazol-2-yl)-N-(2,4-difluorophenyl)piperidine-4-carboxamide (PubChem CID 122176153) has the molecular formula C19H18F2N4O and a molecular weight of 356.38 g/mol. Its IUPAC name is 1-(1H-benzimidazol-2-yl)-N-(2,4-difluorophenyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(1H-benzimidazol-2-yl)-N-(2,4-difluorophenyl)piperidine-4-carboxamide
PubChem CID122176153
Molecular FormulaC19H18F2N4O
Molecular Weight356.38 g/mol
Exact Mass356.14
IUPAC Name1-(1H-benzimidazol-2-yl)-N-(2,4-difluorophenyl)piperidine-4-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)C1CCN(c2nc3ccccc3[nH]2)CC1
InChIInChI=1S/C19H18F2N4O/c20-13-5-6-15(14(21)11-13)22-18(26)12-7-9-25(10-8-12)19-23-16-3-1-2-4-17(16)24-19/h1-6,11-12H,7-10H2,(H,22,26)(H,23,24)
InChIKeyGVXKIWVRHSWMAX-UHFFFAOYSA-N
XLogP3.70
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.38
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1H-benzimidazol-2-yl)-N-(2-bromo-4,6-difluorophenyl)piperidine-4-carboxamide
CID 20882817
methyl 6-[[1-(1H-benzimidazol-2-yl)piperidine-4-carbonyl]amino]-1,3-benzodioxole-5-carboxylate
CID 20882818
1-(6-fluoro-1H-benzimidazol-2-yl)piperidine-4-carboxylic acid
CID 84614259
1-(1H-benzimidazol-2-yl)pyrrolidine-3-carboxylic acid
CID 120963990
1-N,4-N-bis(2,4-difluorophenyl)cyclohexane-1,4-dicarboxamide
CID 26722049
N-(2,4-difluorophenyl)-1-[1-[(3-fluorophenyl)methyl]benzimidazol-2-yl]piperidine-4-carboxamide
CID 20887087
1-(1H-benzimidazol-2-yl)-N-(4-methylcyclohexyl)piperidine-4-carboxamide
CID 20882807
N-(2,4-difluorophenyl)-1-(4-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide
CID 47080331
2-[4-(2,5-difluorophenyl)piperazin-1-yl]-1H-benzimidazole
CID 133410828
N-(2,4-difluorophenyl)-1-pyrazin-2-ylpiperidine-4-carboxamide
CID 3222644
1-(1H-benzimidazol-2-yl)-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide
CID 4130439
N-(2,5-difluorophenyl)-1-(3-methoxyquinoxalin-2-yl)piperidine-4-carboxamide
CID 46367933

Frequently Asked Questions

What is the IUPAC name of 1-(1H-benzimidazol-2-yl)-N-(2,4-difluorophenyl)piperidine-4-carboxamide?
The IUPAC name of 1-(1H-benzimidazol-2-yl)-N-(2,4-difluorophenyl)piperidine-4-carboxamide (CID 122176153) is 1-(1H-benzimidazol-2-yl)-N-(2,4-difluorophenyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(1H-benzimidazol-2-yl)-N-(2,4-difluorophenyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(1H-benzimidazol-2-yl)-N-(2,4-difluorophenyl)piperidine-4-carboxamide is O=C(Nc1ccc(F)cc1F)C1CCN(c2nc3ccccc3[nH]2)CC1.
What is the InChIKey of 1-(1H-benzimidazol-2-yl)-N-(2,4-difluorophenyl)piperidine-4-carboxamide?
The InChIKey is GVXKIWVRHSWMAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18F2N4O/c20-13-5-6-15(14(21)11-13)22-18(26)12-7-9-25(10-8-12)19-23-16-3-1-2-4-17(16)24-19/h1-6,11-12H,7-10H2,(H,22,26)(H,23,24).
What are the key properties of 1-(1H-benzimidazol-2-yl)-N-(2,4-difluorophenyl)piperidine-4-carboxamide?
1-(1H-benzimidazol-2-yl)-N-(2,4-difluorophenyl)piperidine-4-carboxamide has a molecular weight of 356.38 g/mol, XLogP of 3.70, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-benzimidazol-2-yl)-N-(2,4-difluorophenyl)piperidine-4-carboxamide is sourced from PubChem (CID 122176153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).