2-methyl-N-[6-[(2-methylcyclohexyl)amino]-3-pyridinyl]benzamide

C20H25N3O — CID 18419470

IUPAC2-methyl-N-[6-[(2-methylcyclohexyl)amino]-3-pyridinyl]benzamide
SMILESCc1ccccc1C(=O)Nc1ccc(NC2CCCCC2C)nc1
InChIInChI=1S/C20H25N3O/c1-14-7-3-5-9-17(14)20(24)22-16-11-12-19(21-13-16)23-18-10-6-4-8-15(18)2/h3,5,7,9,11-13,15,18H,4,6,8,10H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyGVTIKQWQTHGTTI-UHFFFAOYSA-N
MW323.44 g/mol
LogP4.63
Rot. Bonds4

About 2-methyl-N-[6-[(2-methylcyclohexyl)amino]-3-pyridinyl]benzamide

2-methyl-N-[6-[(2-methylcyclohexyl)amino]-3-pyridinyl]benzamide (PubChem CID 18419470) has the molecular formula C20H25N3O and a molecular weight of 323.44 g/mol. Its IUPAC name is 2-methyl-N-[6-[(2-methylcyclohexyl)amino]-3-pyridinyl]benzamide.

Molecular Properties

Compound Name2-methyl-N-[6-[(2-methylcyclohexyl)amino]-3-pyridinyl]benzamide
PubChem CID18419470
Molecular FormulaC20H25N3O
Molecular Weight323.44 g/mol
Exact Mass323.20
IUPAC Name2-methyl-N-[6-[(2-methylcyclohexyl)amino]-3-pyridinyl]benzamide
SMILESCc1ccccc1C(=O)Nc1ccc(NC2CCCCC2C)nc1
InChIInChI=1S/C20H25N3O/c1-14-7-3-5-9-17(14)20(24)22-16-11-12-19(21-13-16)23-18-10-6-4-8-15(18)2/h3,5,7,9,11-13,15,18H,4,6,8,10H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyGVTIKQWQTHGTTI-UHFFFAOYSA-N
XLogP4.63
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 54.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-[(1R,2S)-2-methylcyclohexyl]benzamide
CID 804412
2-methyl-N-[5-(propan-2-ylamino)-2-pyridinyl]benzamide
CID 113023560
2-methyl-N-[(1S,2S)-2-[(2-methylbenzoyl)amino]cyclohexyl]benzamide
CID 979091
N-[6-(4-bromoanilino)-3-pyridinyl]-2-methylbenzamide
CID 113019208
N-[6-(4-acetylanilino)-3-pyridinyl]-2-methylbenzamide
CID 113020395
2-methyl-N-[6-(pyridin-2-ylmethylamino)-3-pyridinyl]benzamide
CID 113012661
2-amino-N-[5-[(2-methylcyclohexyl)amino]-2-pyridinyl]propanamide
CID 82034129
N-[6-(2-hydroxypropylamino)-3-pyridinyl]-2-methylbenzamide
CID 82022480
5-methyl-N-(2-methylcyclopentyl)pyridin-2-amine
CID 63281216
N-(2-methylcyclohexyl)pyridin-2-amine
CID 43079705
N-[6-(3-cyclopropyl-5-oxo-4H-pyrazol-1-yl)-3-pyridinyl]-2-methylbenzamide
CID 126832703
2-methyl-N-[5-(4-methylanilino)-2-pyridinyl]benzamide
CID 113031534

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[6-[(2-methylcyclohexyl)amino]-3-pyridinyl]benzamide?
The IUPAC name of 2-methyl-N-[6-[(2-methylcyclohexyl)amino]-3-pyridinyl]benzamide (CID 18419470) is 2-methyl-N-[6-[(2-methylcyclohexyl)amino]-3-pyridinyl]benzamide.
What is the SMILES notation for 2-methyl-N-[6-[(2-methylcyclohexyl)amino]-3-pyridinyl]benzamide?
The canonical SMILES for 2-methyl-N-[6-[(2-methylcyclohexyl)amino]-3-pyridinyl]benzamide is Cc1ccccc1C(=O)Nc1ccc(NC2CCCCC2C)nc1.
What is the InChIKey of 2-methyl-N-[6-[(2-methylcyclohexyl)amino]-3-pyridinyl]benzamide?
The InChIKey is GVTIKQWQTHGTTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O/c1-14-7-3-5-9-17(14)20(24)22-16-11-12-19(21-13-16)23-18-10-6-4-8-15(18)2/h3,5,7,9,11-13,15,18H,4,6,8,10H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of 2-methyl-N-[6-[(2-methylcyclohexyl)amino]-3-pyridinyl]benzamide?
2-methyl-N-[6-[(2-methylcyclohexyl)amino]-3-pyridinyl]benzamide has a molecular weight of 323.44 g/mol, XLogP of 4.63, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[6-[(2-methylcyclohexyl)amino]-3-pyridinyl]benzamide is sourced from PubChem (CID 18419470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).