N-(1H-benzimidazol-2-ylmethyl)-N-methylpiperidine-2-carboxamide

C15H20N4O — CID 110462326

IUPACN-(1H-benzimidazol-2-ylmethyl)-N-methylpiperidine-2-carboxamide
SMILESCN(Cc1nc2ccccc2[nH]1)C(=O)C1CCCCN1
InChIInChI=1S/C15H20N4O/c1-19(15(20)13-8-4-5-9-16-13)10-14-17-11-6-2-3-7-12(11)18-14/h2-3,6-7,13,16H,4-5,8-10H2,1H3,(H,17,18)
InChIKeyRSIOTCBUKQAEOM-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.66
Rot. Bonds3

About N-(1H-benzimidazol-2-ylmethyl)-N-methylpiperidine-2-carboxamide

N-(1H-benzimidazol-2-ylmethyl)-N-methylpiperidine-2-carboxamide (PubChem CID 110462326) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is N-(1H-benzimidazol-2-ylmethyl)-N-methylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-(1H-benzimidazol-2-ylmethyl)-N-methylpiperidine-2-carboxamide
PubChem CID110462326
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC NameN-(1H-benzimidazol-2-ylmethyl)-N-methylpiperidine-2-carboxamide
SMILESCN(Cc1nc2ccccc2[nH]1)C(=O)C1CCCCN1
InChIInChI=1S/C15H20N4O/c1-19(15(20)13-8-4-5-9-16-13)10-14-17-11-6-2-3-7-12(11)18-14/h2-3,6-7,13,16H,4-5,8-10H2,1H3,(H,17,18)
InChIKeyRSIOTCBUKQAEOM-UHFFFAOYSA-N
XLogP1.66
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1H-benzimidazol-2-ylmethyl)-N-methylcyclohexanecarboxamide
CID 36516588
1-(1H-benzimidazol-2-ylmethyl)-3-cyclopentyl-1-methylurea
CID 38220835
N-(1H-benzimidazol-2-ylmethyl)-N,2,2-trimethylcyclopropane-1-carboxamide
CID 131949916
(2R)-N-(1,3-benzothiazol-2-ylmethyl)-N-methylpyrrolidine-2-carboxamide
CID 103813341
2-[(3aR,7aR)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]-N-(1H-benzimidazol-2-ylmethyl)-N-methylacetamide
CID 92854492
N-ethyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]piperidine-2-carboxamide
CID 137118075
(2R)-N-methyl-N-(naphthalen-2-ylmethyl)piperidine-2-carboxamide
CID 103808154
(2S)-N-(1,3-benzothiazol-2-ylmethyl)-N-methylpyrrolidine-2-carboxamide;dihydrochloride
CID 119835338
N-(1H-benzimidazol-2-ylmethyl)-2-cyclopentyloxy-N-methylbutanamide
CID 56789407
(2S)-N-benzyl-N-methylpyrrolidine-2-carboxamide
CID 22691346
N-[(2-chlorophenyl)methyl]-N-methylpiperidine-2-carboxamide;hydrochloride
CID 119267602
2-[1H-benzimidazol-2-ylmethyl(methyl)amino]cyclohexan-1-ol
CID 102636442

Frequently Asked Questions

What is the IUPAC name of N-(1H-benzimidazol-2-ylmethyl)-N-methylpiperidine-2-carboxamide?
The IUPAC name of N-(1H-benzimidazol-2-ylmethyl)-N-methylpiperidine-2-carboxamide (CID 110462326) is N-(1H-benzimidazol-2-ylmethyl)-N-methylpiperidine-2-carboxamide.
What is the SMILES notation for N-(1H-benzimidazol-2-ylmethyl)-N-methylpiperidine-2-carboxamide?
The canonical SMILES for N-(1H-benzimidazol-2-ylmethyl)-N-methylpiperidine-2-carboxamide is CN(Cc1nc2ccccc2[nH]1)C(=O)C1CCCCN1.
What is the InChIKey of N-(1H-benzimidazol-2-ylmethyl)-N-methylpiperidine-2-carboxamide?
The InChIKey is RSIOTCBUKQAEOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-19(15(20)13-8-4-5-9-16-13)10-14-17-11-6-2-3-7-12(11)18-14/h2-3,6-7,13,16H,4-5,8-10H2,1H3,(H,17,18).
What are the key properties of N-(1H-benzimidazol-2-ylmethyl)-N-methylpiperidine-2-carboxamide?
N-(1H-benzimidazol-2-ylmethyl)-N-methylpiperidine-2-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 1.66, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-benzimidazol-2-ylmethyl)-N-methylpiperidine-2-carboxamide is sourced from PubChem (CID 110462326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).