(3R)-N-[4-(3-methylbenzimidazol-5-yl)-2-pyridinyl]piperidine-3-carboxamide

C19H21N5O — CID 90412986

IUPAC(3R)-N-[4-(3-methylbenzimidazol-5-yl)-2-pyridinyl]piperidine-3-carboxamide
SMILESCn1cnc2ccc(-c3ccnc(NC(=O)[C@@H]4CCCNC4)c3)cc21
InChIInChI=1S/C19H21N5O/c1-24-12-22-16-5-4-13(9-17(16)24)14-6-8-21-18(10-14)23-19(25)15-3-2-7-20-11-15/h4-6,8-10,12,15,20H,2-3,7,11H2,1H3,(H,21,23,25)/t15-/m1/s1
InChIKeyBBLGDXPPUWQAPK-OAHLLOKOSA-N
MW335.41 g/mol
LogP2.57
Rot. Bonds3

About (3R)-N-[4-(3-methylbenzimidazol-5-yl)-2-pyridinyl]piperidine-3-carboxamide

(3R)-N-[4-(3-methylbenzimidazol-5-yl)-2-pyridinyl]piperidine-3-carboxamide (PubChem CID 90412986) has the molecular formula C19H21N5O and a molecular weight of 335.41 g/mol. Its IUPAC name is (3R)-N-[4-(3-methylbenzimidazol-5-yl)-2-pyridinyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-[4-(3-methylbenzimidazol-5-yl)-2-pyridinyl]piperidine-3-carboxamide
PubChem CID90412986
Molecular FormulaC19H21N5O
Molecular Weight335.41 g/mol
Exact Mass335.17
IUPAC Name(3R)-N-[4-(3-methylbenzimidazol-5-yl)-2-pyridinyl]piperidine-3-carboxamide
SMILESCn1cnc2ccc(-c3ccnc(NC(=O)[C@@H]4CCCNC4)c3)cc21
InChIInChI=1S/C19H21N5O/c1-24-12-22-16-5-4-13(9-17(16)24)14-6-8-21-18(10-14)23-19(25)15-3-2-7-20-11-15/h4-6,8-10,12,15,20H,2-3,7,11H2,1H3,(H,21,23,25)/t15-/m1/s1
InChIKeyBBLGDXPPUWQAPK-OAHLLOKOSA-N
XLogP2.57
TPSA71.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(3R)-N-(1-methyl-3-pyridin-4-ylpyrazol-5-yl)piperidine-3-carboxamide
CID 138001539
N-[5-chloro-4-[3-(2-pyridin-3-ylethyl)benzimidazol-5-yl]-2-pyridinyl]piperidine-3-carboxamide
CID 140653382
(3R)-N-[5-chloro-4-[3-(2-pyridin-3-ylethyl)benzimidazol-5-yl]-2-pyridinyl]piperidine-3-carboxamide
CID 86299078
N-[5-chloro-4-[3-[(4-fluorophenyl)methyl]benzimidazol-5-yl]-2-pyridinyl]piperidine-3-carboxamide
CID 140653411
N-[4-[2-(4-fluoroanilino)-4-pyridinyl]-2-pyridinyl]pyrrolidine-3-carboxamide
CID 67062284
N-pyrazin-2-ylpiperidine-3-carboxamide
CID 43616168
(3R)-N-[5-chloro-4-[1-(1,3-thiazol-4-ylmethyl)benzimidazol-5-yl]-2-pyridinyl]piperidine-3-carboxamide;N-[5-chloro-4-[3-(1,3-thiazol-4-ylmethyl)benzimidazol-5-yl]-2-pyridinyl]piperidine-3-carboxamide
CID 90414253
N-[4-[3-(cyclopropylmethyl)benzimidazol-5-yl]-2-pyridinyl]acetamide
CID 134462843
(3S)-N-[6-(1-methylpyrazol-4-yl)cinnolin-3-yl]piperidine-3-carboxamide
CID 138588985
(3S)-N-(1,2-oxazol-3-yl)piperidine-3-carboxamide
CID 81139342
N-[6-(1-methyltriazol-4-yl)cinnolin-3-yl]piperidine-3-carboxamide
CID 138586977
N-[4-(1-methylbenzimidazol-2-yl)phenyl]piperidine-3-carboxamide;hydrochloride
CID 126772083

Frequently Asked Questions

What is the IUPAC name of (3R)-N-[4-(3-methylbenzimidazol-5-yl)-2-pyridinyl]piperidine-3-carboxamide?
The IUPAC name of (3R)-N-[4-(3-methylbenzimidazol-5-yl)-2-pyridinyl]piperidine-3-carboxamide (CID 90412986) is (3R)-N-[4-(3-methylbenzimidazol-5-yl)-2-pyridinyl]piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-[4-(3-methylbenzimidazol-5-yl)-2-pyridinyl]piperidine-3-carboxamide?
The canonical SMILES for (3R)-N-[4-(3-methylbenzimidazol-5-yl)-2-pyridinyl]piperidine-3-carboxamide is Cn1cnc2ccc(-c3ccnc(NC(=O)[C@@H]4CCCNC4)c3)cc21.
What is the InChIKey of (3R)-N-[4-(3-methylbenzimidazol-5-yl)-2-pyridinyl]piperidine-3-carboxamide?
The InChIKey is BBLGDXPPUWQAPK-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H21N5O/c1-24-12-22-16-5-4-13(9-17(16)24)14-6-8-21-18(10-14)23-19(25)15-3-2-7-20-11-15/h4-6,8-10,12,15,20H,2-3,7,11H2,1H3,(H,21,23,25)/t15-/m1/s1.
What are the key properties of (3R)-N-[4-(3-methylbenzimidazol-5-yl)-2-pyridinyl]piperidine-3-carboxamide?
(3R)-N-[4-(3-methylbenzimidazol-5-yl)-2-pyridinyl]piperidine-3-carboxamide has a molecular weight of 335.41 g/mol, XLogP of 2.57, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-[4-(3-methylbenzimidazol-5-yl)-2-pyridinyl]piperidine-3-carboxamide is sourced from PubChem (CID 90412986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).