4-(1H-benzimidazol-2-yl)-N-(3-fluorophenyl)piperidine-1-carboxamide

C19H19FN4O — CID 23605637

IUPAC4-(1H-benzimidazol-2-yl)-N-(3-fluorophenyl)piperidine-1-carboxamide
SMILESO=C(Nc1cccc(F)c1)N1CCC(c2nc3ccccc3[nH]2)CC1
InChIInChI=1S/C19H19FN4O/c20-14-4-3-5-15(12-14)21-19(25)24-10-8-13(9-11-24)18-22-16-6-1-2-7-17(16)23-18/h1-7,12-13H,8-11H2,(H,21,25)(H,22,23)
InChIKeyLWAAMQCZCJXZRA-UHFFFAOYSA-N
MW338.39 g/mol
LogP4.11
Rot. Bonds2

About 4-(1H-benzimidazol-2-yl)-N-(3-fluorophenyl)piperidine-1-carboxamide

4-(1H-benzimidazol-2-yl)-N-(3-fluorophenyl)piperidine-1-carboxamide (PubChem CID 23605637) has the molecular formula C19H19FN4O and a molecular weight of 338.39 g/mol. Its IUPAC name is 4-(1H-benzimidazol-2-yl)-N-(3-fluorophenyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(1H-benzimidazol-2-yl)-N-(3-fluorophenyl)piperidine-1-carboxamide
PubChem CID23605637
Molecular FormulaC19H19FN4O
Molecular Weight338.39 g/mol
Exact Mass338.15
IUPAC Name4-(1H-benzimidazol-2-yl)-N-(3-fluorophenyl)piperidine-1-carboxamide
SMILESO=C(Nc1cccc(F)c1)N1CCC(c2nc3ccccc3[nH]2)CC1
InChIInChI=1S/C19H19FN4O/c20-14-4-3-5-15(12-14)21-19(25)24-10-8-13(9-11-24)18-22-16-6-1-2-7-17(16)23-18/h1-7,12-13H,8-11H2,(H,21,25)(H,22,23)
InChIKeyLWAAMQCZCJXZRA-UHFFFAOYSA-N
XLogP4.11
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.39
LogP ≤ 54.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(6-chloro-1H-benzimidazol-2-yl)-N-phenylpiperidine-1-carboxamide
CID 1429783
3-(1H-benzimidazol-2-yl)-N-(3-methylphenyl)piperidine-1-carboxamide
CID 44754575
4-(1H-benzimidazol-2-yl)-N-phenylpiperidine-1-carbothioamide
CID 43815863
3-(1H-benzimidazol-2-yl)-N-(3-methoxyphenyl)azetidine-1-carboxamide
CID 90505815
4-(6-chloro-1H-benzimidazol-2-yl)-N-(3-methoxyphenyl)piperidine-1-carboxamide
CID 43815842
4-(2-aminophenyl)-N-(3-fluorophenyl)piperidine-1-carboxamide
CID 170456870
4-(1,3-benzoxazol-2-ylamino)-N-(3-fluorophenyl)piperidine-1-carboxamide
CID 23605340
2-[2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-2-oxoethyl]sulfanyl-N-(3-bromophenyl)acetamide
CID 60571238
4-(6-chloro-1H-benzimidazol-2-yl)-N-(4-chlorophenyl)piperidine-1-carboxamide
CID 1429871
4-(1H-benzimidazol-2-yl)-N-(3-methoxyphenyl)piperidine-1-carbothioamide
CID 1430350
[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-piperazin-1-ylmethanone
CID 142409937
4-(1H-benzimidazol-2-yl)-N-[2-methyl-3-(pyrrolidine-1-carbonyl)phenyl]piperidine-1-carboxamide
CID 166205070

Frequently Asked Questions

What is the IUPAC name of 4-(1H-benzimidazol-2-yl)-N-(3-fluorophenyl)piperidine-1-carboxamide?
The IUPAC name of 4-(1H-benzimidazol-2-yl)-N-(3-fluorophenyl)piperidine-1-carboxamide (CID 23605637) is 4-(1H-benzimidazol-2-yl)-N-(3-fluorophenyl)piperidine-1-carboxamide.
What is the SMILES notation for 4-(1H-benzimidazol-2-yl)-N-(3-fluorophenyl)piperidine-1-carboxamide?
The canonical SMILES for 4-(1H-benzimidazol-2-yl)-N-(3-fluorophenyl)piperidine-1-carboxamide is O=C(Nc1cccc(F)c1)N1CCC(c2nc3ccccc3[nH]2)CC1.
What is the InChIKey of 4-(1H-benzimidazol-2-yl)-N-(3-fluorophenyl)piperidine-1-carboxamide?
The InChIKey is LWAAMQCZCJXZRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN4O/c20-14-4-3-5-15(12-14)21-19(25)24-10-8-13(9-11-24)18-22-16-6-1-2-7-17(16)23-18/h1-7,12-13H,8-11H2,(H,21,25)(H,22,23).
What are the key properties of 4-(1H-benzimidazol-2-yl)-N-(3-fluorophenyl)piperidine-1-carboxamide?
4-(1H-benzimidazol-2-yl)-N-(3-fluorophenyl)piperidine-1-carboxamide has a molecular weight of 338.39 g/mol, XLogP of 4.11, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1H-benzimidazol-2-yl)-N-(3-fluorophenyl)piperidine-1-carboxamide is sourced from PubChem (CID 23605637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).