3-methyl-N-(8-methylquinolin-5-yl)piperidine-2-carboxamide

C17H21N3O — CID 107067502

IUPAC3-methyl-N-(8-methylquinolin-5-yl)piperidine-2-carboxamide
SMILESCc1ccc(NC(=O)C2NCCCC2C)c2cccnc12
InChIInChI=1S/C17H21N3O/c1-11-5-3-9-19-16(11)17(21)20-14-8-7-12(2)15-13(14)6-4-10-18-15/h4,6-8,10-11,16,19H,3,5,9H2,1-2H3,(H,20,21)
InChIKeyWIWZFECCIYRHLH-UHFFFAOYSA-N
MW283.37 g/mol
LogP2.87
Rot. Bonds2

About 3-methyl-N-(8-methylquinolin-5-yl)piperidine-2-carboxamide

3-methyl-N-(8-methylquinolin-5-yl)piperidine-2-carboxamide (PubChem CID 107067502) has the molecular formula C17H21N3O and a molecular weight of 283.37 g/mol. Its IUPAC name is 3-methyl-N-(8-methylquinolin-5-yl)piperidine-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(8-methylquinolin-5-yl)piperidine-2-carboxamide
PubChem CID107067502
Molecular FormulaC17H21N3O
Molecular Weight283.37 g/mol
Exact Mass283.17
IUPAC Name3-methyl-N-(8-methylquinolin-5-yl)piperidine-2-carboxamide
SMILESCc1ccc(NC(=O)C2NCCCC2C)c2cccnc12
InChIInChI=1S/C17H21N3O/c1-11-5-3-9-19-16(11)17(21)20-14-8-7-12(2)15-13(14)6-4-10-18-15/h4,6-8,10-11,16,19H,3,5,9H2,1-2H3,(H,20,21)
InChIKeyWIWZFECCIYRHLH-UHFFFAOYSA-N
XLogP2.87
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)piperidine-2-carboxamide
CID 107067527
N-(2-bromo-3-methylphenyl)-3-methylpiperidine-2-carboxamide
CID 107068466
N-(4-fluoro-2-methylphenyl)-3-methylpiperidine-2-carboxamide
CID 62339106
N-(5-iodo-2-methylphenyl)-3-methylpiperidine-2-carboxamide
CID 114257371
3-methyl-N-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboxamide
CID 107068180
N-(8-methylquinolin-5-yl)-1,3-thiazolidine-4-carboxamide
CID 43712886
3-methyl-N-(4-methyl-2-pyridinyl)piperidine-2-carboxamide
CID 107067167
N-(2,6-difluoro-3-methylphenyl)-3-methylpiperidine-2-carboxamide
CID 82819007
3-methyl-N-(2,4,6-trimethylphenyl)piperidine-2-carboxamide
CID 62340619
methyl 5-methyl-2-[(3-methylpiperidine-2-carbonyl)amino]benzoate
CID 107067304
3-methyl-N-(5-methyl-1,2-oxazol-3-yl)piperidine-2-carboxamide
CID 107067103
3-methyl-N-(4-methyl-3-pyridinyl)pyrrolidine-2-carboxamide
CID 102779438

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(8-methylquinolin-5-yl)piperidine-2-carboxamide?
The IUPAC name of 3-methyl-N-(8-methylquinolin-5-yl)piperidine-2-carboxamide (CID 107067502) is 3-methyl-N-(8-methylquinolin-5-yl)piperidine-2-carboxamide.
What is the SMILES notation for 3-methyl-N-(8-methylquinolin-5-yl)piperidine-2-carboxamide?
The canonical SMILES for 3-methyl-N-(8-methylquinolin-5-yl)piperidine-2-carboxamide is Cc1ccc(NC(=O)C2NCCCC2C)c2cccnc12.
What is the InChIKey of 3-methyl-N-(8-methylquinolin-5-yl)piperidine-2-carboxamide?
The InChIKey is WIWZFECCIYRHLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-11-5-3-9-19-16(11)17(21)20-14-8-7-12(2)15-13(14)6-4-10-18-15/h4,6-8,10-11,16,19H,3,5,9H2,1-2H3,(H,20,21).
What are the key properties of 3-methyl-N-(8-methylquinolin-5-yl)piperidine-2-carboxamide?
3-methyl-N-(8-methylquinolin-5-yl)piperidine-2-carboxamide has a molecular weight of 283.37 g/mol, XLogP of 2.87, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(8-methylquinolin-5-yl)piperidine-2-carboxamide is sourced from PubChem (CID 107067502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).