N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]pyridine-4-carboxamide

C20H23N5O — CID 19576141

IUPACN-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]pyridine-4-carboxamide
SMILESO=C(Nc1nc2ccccc2n1CCN1CCCCC1)c1ccncc1
InChIInChI=1S/C20H23N5O/c26-19(16-8-10-21-11-9-16)23-20-22-17-6-2-3-7-18(17)25(20)15-14-24-12-4-1-5-13-24/h2-3,6-11H,1,4-5,12-15H2,(H,22,23,26)
InChIKeyXBVGEAWHFYDYCC-UHFFFAOYSA-N
MW349.44 g/mol
LogP3.17
Rot. Bonds5

About N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]pyridine-4-carboxamide

N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]pyridine-4-carboxamide (PubChem CID 19576141) has the molecular formula C20H23N5O and a molecular weight of 349.44 g/mol. Its IUPAC name is N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]pyridine-4-carboxamide
PubChem CID19576141
Molecular FormulaC20H23N5O
Molecular Weight349.44 g/mol
Exact Mass349.19
IUPAC NameN-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]pyridine-4-carboxamide
SMILESO=C(Nc1nc2ccccc2n1CCN1CCCCC1)c1ccncc1
InChIInChI=1S/C20H23N5O/c26-19(16-8-10-21-11-9-16)23-20-22-17-6-2-3-7-18(17)25(20)15-14-24-12-4-1-5-13-24/h2-3,6-11H,1,4-5,12-15H2,(H,22,23,26)
InChIKeyXBVGEAWHFYDYCC-UHFFFAOYSA-N
XLogP3.17
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.44
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]pyrazine-2-carboxamide
CID 118725842
2,6-difluoro-N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]benzamide
CID 17374527
2-fluoro-N-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]benzamide
CID 118725742
3-ethoxy-N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]benzamide
CID 35592391
2,5-dimethyl-N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]furan-3-carboxamide
CID 35524627
1-(4-methoxyphenyl)-3-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]urea
CID 39735359
2-[[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]amino]ethanol chloride
CID 53313615
N-methyl-1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-amine
CID 82359477
5-[(4-chloropyrazol-1-yl)methyl]-N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]furan-2-carboxamide
CID 35523435
N-(1-octylbenzimidazol-2-yl)benzamide
CID 21449929
ethane;N-[1-[2-(4-methylpiperazin-1-yl)ethyl]benzimidazol-2-yl]-3-nitrobenzamide
CID 159428795
N-[1-(2-morpholin-4-ylethyl)benzimidazol-2-yl]-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide
CID 91959274

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]pyridine-4-carboxamide?
The IUPAC name of N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]pyridine-4-carboxamide (CID 19576141) is N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]pyridine-4-carboxamide.
What is the SMILES notation for N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]pyridine-4-carboxamide?
The canonical SMILES for N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]pyridine-4-carboxamide is O=C(Nc1nc2ccccc2n1CCN1CCCCC1)c1ccncc1.
What is the InChIKey of N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]pyridine-4-carboxamide?
The InChIKey is XBVGEAWHFYDYCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O/c26-19(16-8-10-21-11-9-16)23-20-22-17-6-2-3-7-18(17)25(20)15-14-24-12-4-1-5-13-24/h2-3,6-11H,1,4-5,12-15H2,(H,22,23,26).
What are the key properties of N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]pyridine-4-carboxamide?
N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]pyridine-4-carboxamide has a molecular weight of 349.44 g/mol, XLogP of 3.17, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]pyridine-4-carboxamide is sourced from PubChem (CID 19576141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).