5-(4-methylpiperidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)pyridine-3-carboxamide

C22H29N3O — CID 109227277

IUPAC5-(4-methylpiperidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)pyridine-3-carboxamide
SMILESCc1cccc(C(C)C)c1NC(=O)c1cncc(N2CCC(C)CC2)c1
InChIInChI=1S/C22H29N3O/c1-15(2)20-7-5-6-17(4)21(20)24-22(26)18-12-19(14-23-13-18)25-10-8-16(3)9-11-25/h5-7,12-16H,8-11H2,1-4H3,(H,24,26)
InChIKeyLOUMAJQGLJLOQA-UHFFFAOYSA-N
MW351.49 g/mol
LogP5.00
Rot. Bonds4

About 5-(4-methylpiperidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)pyridine-3-carboxamide

5-(4-methylpiperidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)pyridine-3-carboxamide (PubChem CID 109227277) has the molecular formula C22H29N3O and a molecular weight of 351.49 g/mol. Its IUPAC name is 5-(4-methylpiperidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(4-methylpiperidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)pyridine-3-carboxamide
PubChem CID109227277
Molecular FormulaC22H29N3O
Molecular Weight351.49 g/mol
Exact Mass351.23
IUPAC Name5-(4-methylpiperidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)pyridine-3-carboxamide
SMILESCc1cccc(C(C)C)c1NC(=O)c1cncc(N2CCC(C)CC2)c1
InChIInChI=1S/C22H29N3O/c1-15(2)20-7-5-6-17(4)21(20)24-22(26)18-12-19(14-23-13-18)25-10-8-16(3)9-11-25/h5-7,12-16H,8-11H2,1-4H3,(H,24,26)
InChIKeyLOUMAJQGLJLOQA-UHFFFAOYSA-N
XLogP5.00
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.49
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-methylpiperidin-1-yl)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide
CID 109227275
3-(4-methylpiperidine-1-carbonyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide
CID 109052346
2-methyl-6-(4-methylpiperidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)pyrimidine-4-carboxamide
CID 109364180
N-(4-chloro-2-methylphenyl)-5-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 109227287
N-(4-chlorophenyl)-5-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 109227284
N-(3-methoxyphenyl)-5-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 109227296
N-(4-bromophenyl)-5-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 109227293
5-anilino-N-(2-methyl-6-propan-2-ylphenyl)pyridine-3-carboxamide
CID 109241555
N-(2-ethoxyphenyl)-5-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 109227298
N-(2-methyl-6-propan-2-ylphenyl)-5-(2-methylpropylamino)pyridine-3-carboxamide
CID 109225028
N-(2-methylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide
CID 109228626
6-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyridine-3-carboxamide
CID 18148418

Frequently Asked Questions

What is the IUPAC name of 5-(4-methylpiperidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)pyridine-3-carboxamide?
The IUPAC name of 5-(4-methylpiperidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)pyridine-3-carboxamide (CID 109227277) is 5-(4-methylpiperidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-(4-methylpiperidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-(4-methylpiperidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)pyridine-3-carboxamide is Cc1cccc(C(C)C)c1NC(=O)c1cncc(N2CCC(C)CC2)c1.
What is the InChIKey of 5-(4-methylpiperidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)pyridine-3-carboxamide?
The InChIKey is LOUMAJQGLJLOQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N3O/c1-15(2)20-7-5-6-17(4)21(20)24-22(26)18-12-19(14-23-13-18)25-10-8-16(3)9-11-25/h5-7,12-16H,8-11H2,1-4H3,(H,24,26).
What are the key properties of 5-(4-methylpiperidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)pyridine-3-carboxamide?
5-(4-methylpiperidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)pyridine-3-carboxamide has a molecular weight of 351.49 g/mol, XLogP of 5.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylpiperidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109227277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).