N-[(2-methylphenyl)methyl]-6-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide

C21H25N3O2 — CID 109095422

IUPACN-[(2-methylphenyl)methyl]-6-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
SMILESCc1ccccc1CNC(=O)c1cccc(C(=O)N2CCC(C)CC2)n1
InChIInChI=1S/C21H25N3O2/c1-15-10-12-24(13-11-15)21(26)19-9-5-8-18(23-19)20(25)22-14-17-7-4-3-6-16(17)2/h3-9,15H,10-14H2,1-2H3,(H,22,25)
InChIKeyVWCFKEFXMKWGRE-UHFFFAOYSA-N
MW351.45 g/mol
LogP3.19
Rot. Bonds4

About N-[(2-methylphenyl)methyl]-6-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide

N-[(2-methylphenyl)methyl]-6-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide (PubChem CID 109095422) has the molecular formula C21H25N3O2 and a molecular weight of 351.45 g/mol. Its IUPAC name is N-[(2-methylphenyl)methyl]-6-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(2-methylphenyl)methyl]-6-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
PubChem CID109095422
Molecular FormulaC21H25N3O2
Molecular Weight351.45 g/mol
Exact Mass351.19
IUPAC NameN-[(2-methylphenyl)methyl]-6-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
SMILESCc1ccccc1CNC(=O)c1cccc(C(=O)N2CCC(C)CC2)n1
InChIInChI=1S/C21H25N3O2/c1-15-10-12-24(13-11-15)21(26)19-9-5-8-18(23-19)20(25)22-14-17-7-4-3-6-16(17)2/h3-9,15H,10-14H2,1-2H3,(H,22,25)
InChIKeyVWCFKEFXMKWGRE-UHFFFAOYSA-N
XLogP3.19
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.45
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methoxyethyl)-6-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109095409
N-[2-(dimethylamino)ethyl]-6-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109095413
[6-[(2-methylphenyl)methylamino]pyridazin-3-yl]-(4-methylpiperidin-1-yl)methanone
CID 109113327
N-(3-methoxypropyl)-6-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109095410
2-N-benzyl-6-N-[(2-methylphenyl)methyl]pyridine-2,6-dicarboxamide
CID 109097211
N-[(2-fluorophenyl)methyl]-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
CID 109094778
6-(4-methylpiperidine-1-carbonyl)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 109095414
N-(3,5-dimethylphenyl)-6-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109095481
N-(2,4-dimethylphenyl)-6-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109095478
6-N-butan-2-yl-2-N-[(2-methylphenyl)methyl]pyridine-2,6-dicarboxamide
CID 109094588
6-N-(2,3-dimethylphenyl)-2-N-[(2-methylphenyl)methyl]pyridine-2,6-dicarboxamide
CID 109097371
6-N-(3-chloro-2-methylphenyl)-2-N-[(2-methylphenyl)methyl]pyridine-2,6-dicarboxamide
CID 109097382

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylphenyl)methyl]-6-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide?
The IUPAC name of N-[(2-methylphenyl)methyl]-6-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide (CID 109095422) is N-[(2-methylphenyl)methyl]-6-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide.
What is the SMILES notation for N-[(2-methylphenyl)methyl]-6-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide?
The canonical SMILES for N-[(2-methylphenyl)methyl]-6-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide is Cc1ccccc1CNC(=O)c1cccc(C(=O)N2CCC(C)CC2)n1.
What is the InChIKey of N-[(2-methylphenyl)methyl]-6-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide?
The InChIKey is VWCFKEFXMKWGRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O2/c1-15-10-12-24(13-11-15)21(26)19-9-5-8-18(23-19)20(25)22-14-17-7-4-3-6-16(17)2/h3-9,15H,10-14H2,1-2H3,(H,22,25).
What are the key properties of N-[(2-methylphenyl)methyl]-6-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide?
N-[(2-methylphenyl)methyl]-6-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide has a molecular weight of 351.45 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylphenyl)methyl]-6-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide is sourced from PubChem (CID 109095422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).