N-(piperidin-3-ylmethyl)quinoline-6-carboxamide

C16H19N3O — CID 62874382

IUPACN-(piperidin-3-ylmethyl)quinoline-6-carboxamide
SMILESO=C(NCC1CCCNC1)c1ccc2ncccc2c1
InChIInChI=1S/C16H19N3O/c20-16(19-11-12-3-1-7-17-10-12)14-5-6-15-13(9-14)4-2-8-18-15/h2,4-6,8-9,12,17H,1,3,7,10-11H2,(H,19,20)
InChIKeyOUJNCMPAHQNYBG-UHFFFAOYSA-N
MW269.35 g/mol
LogP1.96
Rot. Bonds3

About N-(piperidin-3-ylmethyl)quinoline-6-carboxamide

N-(piperidin-3-ylmethyl)quinoline-6-carboxamide (PubChem CID 62874382) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is N-(piperidin-3-ylmethyl)quinoline-6-carboxamide.

Molecular Properties

Compound NameN-(piperidin-3-ylmethyl)quinoline-6-carboxamide
PubChem CID62874382
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC NameN-(piperidin-3-ylmethyl)quinoline-6-carboxamide
SMILESO=C(NCC1CCCNC1)c1ccc2ncccc2c1
InChIInChI=1S/C16H19N3O/c20-16(19-11-12-3-1-7-17-10-12)14-5-6-15-13(9-14)4-2-8-18-15/h2,4-6,8-9,12,17H,1,3,7,10-11H2,(H,19,20)
InChIKeyOUJNCMPAHQNYBG-UHFFFAOYSA-N
XLogP1.96
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-aminocyclobutyl)methyl]quinoline-6-carboxamide
CID 66004939
N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119461032
3-N-(piperidin-3-ylmethyl)benzene-1,3-dicarboxamide;hydrochloride
CID 119463124
N-[(3S)-pyrrolidin-3-yl]quinoline-6-carboxamide
CID 79688925
N-(pyrrolidin-3-ylmethyl)naphthalene-2-carboxamide
CID 80564611
N-(piperidin-3-ylmethyl)-1H-indole-5-carboxamide
CID 55230606
2-methyl-N-(piperidin-3-ylmethyl)pyridine-3-carboxamide;dihydrochloride
CID 119462332
4-fluoro-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119462898
3-iodo-4-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 119464322
N-(piperidin-3-ylmethyl)quinoxaline-5-carboxamide
CID 104615453
N-(piperidin-3-ylmethyl)-4-pyrazol-1-ylbenzamide
CID 119461275
4-(dimethylamino)-N-(piperidin-3-ylmethyl)benzamide
CID 43329219

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-3-ylmethyl)quinoline-6-carboxamide?
The IUPAC name of N-(piperidin-3-ylmethyl)quinoline-6-carboxamide (CID 62874382) is N-(piperidin-3-ylmethyl)quinoline-6-carboxamide.
What is the SMILES notation for N-(piperidin-3-ylmethyl)quinoline-6-carboxamide?
The canonical SMILES for N-(piperidin-3-ylmethyl)quinoline-6-carboxamide is O=C(NCC1CCCNC1)c1ccc2ncccc2c1.
What is the InChIKey of N-(piperidin-3-ylmethyl)quinoline-6-carboxamide?
The InChIKey is OUJNCMPAHQNYBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c20-16(19-11-12-3-1-7-17-10-12)14-5-6-15-13(9-14)4-2-8-18-15/h2,4-6,8-9,12,17H,1,3,7,10-11H2,(H,19,20).
What are the key properties of N-(piperidin-3-ylmethyl)quinoline-6-carboxamide?
N-(piperidin-3-ylmethyl)quinoline-6-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 1.96, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-3-ylmethyl)quinoline-6-carboxamide is sourced from PubChem (CID 62874382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).