N-[1-(3-methylbenzoyl)piperidin-4-yl]pyridine-2-carboxamide

C19H21N3O2 — CID 110820295

IUPACN-[1-(3-methylbenzoyl)piperidin-4-yl]pyridine-2-carboxamide
SMILESCc1cccc(C(=O)N2CCC(NC(=O)c3ccccn3)CC2)c1
InChIInChI=1S/C19H21N3O2/c1-14-5-4-6-15(13-14)19(24)22-11-8-16(9-12-22)21-18(23)17-7-2-3-10-20-17/h2-7,10,13,16H,8-9,11-12H2,1H3,(H,21,23)
InChIKeyAWZRTYUVTFZCQZ-UHFFFAOYSA-N
MW323.40 g/mol
LogP2.42
Rot. Bonds3

About N-[1-(3-methylbenzoyl)piperidin-4-yl]pyridine-2-carboxamide

N-[1-(3-methylbenzoyl)piperidin-4-yl]pyridine-2-carboxamide (PubChem CID 110820295) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is N-[1-(3-methylbenzoyl)piperidin-4-yl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(3-methylbenzoyl)piperidin-4-yl]pyridine-2-carboxamide
PubChem CID110820295
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC NameN-[1-(3-methylbenzoyl)piperidin-4-yl]pyridine-2-carboxamide
SMILESCc1cccc(C(=O)N2CCC(NC(=O)c3ccccn3)CC2)c1
InChIInChI=1S/C19H21N3O2/c1-14-5-4-6-15(13-14)19(24)22-11-8-16(9-12-22)21-18(23)17-7-2-3-10-20-17/h2-7,10,13,16H,8-9,11-12H2,1H3,(H,21,23)
InChIKeyAWZRTYUVTFZCQZ-UHFFFAOYSA-N
XLogP2.42
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(3-chlorobenzoyl)piperidin-4-yl]pyridine-2-carboxamide
CID 110821025
N-[1-(3-cyanobenzoyl)piperidin-4-yl]pyridine-2-carboxamide
CID 110820497
N-[1-(3,5-dihydroxybenzoyl)piperidin-4-yl]pyridine-2-carboxamide
CID 108557881
2-chloro-N-[1-(3-methylbenzoyl)piperidin-4-yl]acetamide
CID 108566071
4-tert-butyl-N-[1-(3-methylbenzoyl)piperidin-4-yl]benzamide
CID 108554160
N-[1-(3-methylbenzoyl)piperidin-4-yl]cyclopentanecarboxamide
CID 110820278
3-methoxy-N-[1-(pyridine-2-carbonyl)piperidin-4-yl]benzamide
CID 47029925
N-cyclopropyl-4-[4-(3-methylphenyl)piperazine-1-carbonyl]pyridine-2-carboxamide
CID 109078658
N-[1-(3-methylbenzoyl)piperidin-4-yl]-3H-benzimidazole-5-carboxamide
CID 108554529
4-(dimethylamino)-N-[1-(3-methylbenzoyl)piperidin-4-yl]benzamide
CID 108557963
N-[1-(2-bromobenzoyl)piperidin-4-yl]pyridine-2-carboxamide
CID 108557809
[3-[4-[(3-methylbenzoyl)amino]piperidine-1-carbonyl]phenyl] acetate
CID 108555308

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methylbenzoyl)piperidin-4-yl]pyridine-2-carboxamide?
The IUPAC name of N-[1-(3-methylbenzoyl)piperidin-4-yl]pyridine-2-carboxamide (CID 110820295) is N-[1-(3-methylbenzoyl)piperidin-4-yl]pyridine-2-carboxamide.
What is the SMILES notation for N-[1-(3-methylbenzoyl)piperidin-4-yl]pyridine-2-carboxamide?
The canonical SMILES for N-[1-(3-methylbenzoyl)piperidin-4-yl]pyridine-2-carboxamide is Cc1cccc(C(=O)N2CCC(NC(=O)c3ccccn3)CC2)c1.
What is the InChIKey of N-[1-(3-methylbenzoyl)piperidin-4-yl]pyridine-2-carboxamide?
The InChIKey is AWZRTYUVTFZCQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-14-5-4-6-15(13-14)19(24)22-11-8-16(9-12-22)21-18(23)17-7-2-3-10-20-17/h2-7,10,13,16H,8-9,11-12H2,1H3,(H,21,23).
What are the key properties of N-[1-(3-methylbenzoyl)piperidin-4-yl]pyridine-2-carboxamide?
N-[1-(3-methylbenzoyl)piperidin-4-yl]pyridine-2-carboxamide has a molecular weight of 323.40 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-methylbenzoyl)piperidin-4-yl]pyridine-2-carboxamide is sourced from PubChem (CID 110820295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).