N-(4-methylpiperidin-4-yl)quinoline-5-carboxamide

C16H19N3O — CID 114696345

IUPACN-(4-methylpiperidin-4-yl)quinoline-5-carboxamide
SMILESCC1(NC(=O)c2cccc3ncccc23)CCNCC1
InChIInChI=1S/C16H19N3O/c1-16(7-10-17-11-8-16)19-15(20)13-4-2-6-14-12(13)5-3-9-18-14/h2-6,9,17H,7-8,10-11H2,1H3,(H,19,20)
InChIKeyZYDSUJAWGFLTMR-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.11
Rot. Bonds2

About N-(4-methylpiperidin-4-yl)quinoline-5-carboxamide

N-(4-methylpiperidin-4-yl)quinoline-5-carboxamide (PubChem CID 114696345) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is N-(4-methylpiperidin-4-yl)quinoline-5-carboxamide.

Molecular Properties

Compound NameN-(4-methylpiperidin-4-yl)quinoline-5-carboxamide
PubChem CID114696345
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC NameN-(4-methylpiperidin-4-yl)quinoline-5-carboxamide
SMILESCC1(NC(=O)c2cccc3ncccc23)CCNCC1
InChIInChI=1S/C16H19N3O/c1-16(7-10-17-11-8-16)19-15(20)13-4-2-6-14-12(13)5-3-9-18-14/h2-6,9,17H,7-8,10-11H2,1H3,(H,19,20)
InChIKeyZYDSUJAWGFLTMR-UHFFFAOYSA-N
XLogP2.11
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 ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-hydroxy-N-(4-methylpiperidin-4-yl)pyridine-2-carboxamide
CID 114696622
2-hydroxy-3-methoxy-N-(4-methylpiperidin-4-yl)benzamide
CID 114696306
4-ethyl-N-quinolin-5-ylpiperidine-4-carboxamide
CID 63127284
(2S,3R)-3-hydroxy-2-(quinoline-5-carbonylamino)butanoic acid
CID 104964931
3-chloro-2-fluoro-N-(4-methylpiperidin-4-yl)benzamide
CID 114696417
(2R)-2-(quinoline-5-carbonylamino)propanoic acid
CID 54990837
N-(4-methylazepan-4-yl)-1H-benzimidazole-4-carboxamide
CID 69470702
(2S)-3-methyl-2-(quinoline-5-carbonylamino)butanoic acid
CID 61137612
N-[(1-hydroxycyclobutyl)methyl]quinoline-5-carboxamide
CID 115668807
3-hydroxy-N-(3-methylpyrrolidin-3-yl)pyridine-2-carboxamide
CID 107423037
N-(4-hydroxypentyl)quinoline-5-carboxamide
CID 107300441
N-(3-bromo-2,2-dimethylpropyl)quinoline-5-carboxamide
CID 115364916

Frequently Asked Questions

What is the IUPAC name of N-(4-methylpiperidin-4-yl)quinoline-5-carboxamide?
The IUPAC name of N-(4-methylpiperidin-4-yl)quinoline-5-carboxamide (CID 114696345) is N-(4-methylpiperidin-4-yl)quinoline-5-carboxamide.
What is the SMILES notation for N-(4-methylpiperidin-4-yl)quinoline-5-carboxamide?
The canonical SMILES for N-(4-methylpiperidin-4-yl)quinoline-5-carboxamide is CC1(NC(=O)c2cccc3ncccc23)CCNCC1.
What is the InChIKey of N-(4-methylpiperidin-4-yl)quinoline-5-carboxamide?
The InChIKey is ZYDSUJAWGFLTMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-16(7-10-17-11-8-16)19-15(20)13-4-2-6-14-12(13)5-3-9-18-14/h2-6,9,17H,7-8,10-11H2,1H3,(H,19,20).
What are the key properties of N-(4-methylpiperidin-4-yl)quinoline-5-carboxamide?
N-(4-methylpiperidin-4-yl)quinoline-5-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 2.11, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylpiperidin-4-yl)quinoline-5-carboxamide is sourced from PubChem (CID 114696345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).