4-methyl-N-quinolin-6-ylpiperidine-2-carboxamide

C16H19N3O — CID 114423932

IUPAC4-methyl-N-quinolin-6-ylpiperidine-2-carboxamide
SMILESCC1CCNC(C(=O)Nc2ccc3ncccc3c2)C1
InChIInChI=1S/C16H19N3O/c1-11-6-8-18-15(9-11)16(20)19-13-4-5-14-12(10-13)3-2-7-17-14/h2-5,7,10-11,15,18H,6,8-9H2,1H3,(H,19,20)
InChIKeyLTHUPEPYXPITMM-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.56
Rot. Bonds2

About 4-methyl-N-quinolin-6-ylpiperidine-2-carboxamide

4-methyl-N-quinolin-6-ylpiperidine-2-carboxamide (PubChem CID 114423932) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 4-methyl-N-quinolin-6-ylpiperidine-2-carboxamide.

Molecular Properties

Compound Name4-methyl-N-quinolin-6-ylpiperidine-2-carboxamide
PubChem CID114423932
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name4-methyl-N-quinolin-6-ylpiperidine-2-carboxamide
SMILESCC1CCNC(C(=O)Nc2ccc3ncccc3c2)C1
InChIInChI=1S/C16H19N3O/c1-11-6-8-18-15(9-11)16(20)19-13-4-5-14-12(10-13)3-2-7-17-14/h2-5,7,10-11,15,18H,6,8-9H2,1H3,(H,19,20)
InChIKeyLTHUPEPYXPITMM-UHFFFAOYSA-N
XLogP2.56
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-quinolin-6-ylpiperidine-2-carboxamide?
The IUPAC name of 4-methyl-N-quinolin-6-ylpiperidine-2-carboxamide (CID 114423932) is 4-methyl-N-quinolin-6-ylpiperidine-2-carboxamide.
What is the SMILES notation for 4-methyl-N-quinolin-6-ylpiperidine-2-carboxamide?
The canonical SMILES for 4-methyl-N-quinolin-6-ylpiperidine-2-carboxamide is CC1CCNC(C(=O)Nc2ccc3ncccc3c2)C1.
What is the InChIKey of 4-methyl-N-quinolin-6-ylpiperidine-2-carboxamide?
The InChIKey is LTHUPEPYXPITMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-11-6-8-18-15(9-11)16(20)19-13-4-5-14-12(10-13)3-2-7-17-14/h2-5,7,10-11,15,18H,6,8-9H2,1H3,(H,19,20).
What are the key properties of 4-methyl-N-quinolin-6-ylpiperidine-2-carboxamide?
4-methyl-N-quinolin-6-ylpiperidine-2-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 2.56, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-quinolin-6-ylpiperidine-2-carboxamide is sourced from PubChem (CID 114423932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).