6-(3,4-dihydro-2H-quinolin-1-yl)-N-methylpyridine-3-carboxamide

C16H17N3O — CID 84570471

IUPAC6-(3,4-dihydro-2H-quinolin-1-yl)-N-methylpyridine-3-carboxamide
SMILESCNC(=O)c1ccc(N2CCCc3ccccc32)nc1
InChIInChI=1S/C16H17N3O/c1-17-16(20)13-8-9-15(18-11-13)19-10-4-6-12-5-2-3-7-14(12)19/h2-3,5,7-9,11H,4,6,10H2,1H3,(H,17,20)
InChIKeyNISMXIATTZGOKW-UHFFFAOYSA-N
MW267.33 g/mol
LogP2.53
Rot. Bonds2

About 6-(3,4-dihydro-2H-quinolin-1-yl)-N-methylpyridine-3-carboxamide

6-(3,4-dihydro-2H-quinolin-1-yl)-N-methylpyridine-3-carboxamide (PubChem CID 84570471) has the molecular formula C16H17N3O and a molecular weight of 267.33 g/mol. Its IUPAC name is 6-(3,4-dihydro-2H-quinolin-1-yl)-N-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-(3,4-dihydro-2H-quinolin-1-yl)-N-methylpyridine-3-carboxamide
PubChem CID84570471
Molecular FormulaC16H17N3O
Molecular Weight267.33 g/mol
Exact Mass267.14
IUPAC Name6-(3,4-dihydro-2H-quinolin-1-yl)-N-methylpyridine-3-carboxamide
SMILESCNC(=O)c1ccc(N2CCCc3ccccc32)nc1
InChIInChI=1S/C16H17N3O/c1-17-16(20)13-8-9-15(18-11-13)19-10-4-6-12-5-2-3-7-14(12)19/h2-3,5,7-9,11H,4,6,10H2,1H3,(H,17,20)
InChIKeyNISMXIATTZGOKW-UHFFFAOYSA-N
XLogP2.53
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(3,4-dihydro-2H-quinolin-1-yl)-N-pyridin-2-ylpyridine-3-carboxamide
CID 84570413
N-(4-chlorophenyl)-6-(3,4-dihydro-2H-quinolin-1-yl)pyridine-3-carboxamide
CID 109162476
6-(3,4-dihydro-2H-quinolin-1-yl)-N-(2-methoxyphenyl)pyridine-3-carboxamide
CID 84570395
6-(3,4-dihydro-2H-quinolin-1-yl)-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide
CID 109155759
6-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-ethoxyphenyl)pyridine-3-carboxamide
CID 109162480
N-(2,4-difluorophenyl)-6-(3,4-dihydro-2H-quinolin-1-yl)pyridine-3-carboxamide
CID 109162499
6-(2,3-dihydroindol-1-yl)-N-(4-methylpiperazin-1-yl)pyridine-3-carboxamide
CID 84570390
[6-(3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 109162500
6-(2,3-dihydroindol-1-yl)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide
CID 84570241
1-[6-(3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]-N-methylmethanamine
CID 62280507
N-(3-chloro-4-methylphenyl)-6-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 109162396
N-[2-(diethylamino)ethyl]-6-(2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 84570324

Frequently Asked Questions

What is the IUPAC name of 6-(3,4-dihydro-2H-quinolin-1-yl)-N-methylpyridine-3-carboxamide?
The IUPAC name of 6-(3,4-dihydro-2H-quinolin-1-yl)-N-methylpyridine-3-carboxamide (CID 84570471) is 6-(3,4-dihydro-2H-quinolin-1-yl)-N-methylpyridine-3-carboxamide.
What is the SMILES notation for 6-(3,4-dihydro-2H-quinolin-1-yl)-N-methylpyridine-3-carboxamide?
The canonical SMILES for 6-(3,4-dihydro-2H-quinolin-1-yl)-N-methylpyridine-3-carboxamide is CNC(=O)c1ccc(N2CCCc3ccccc32)nc1.
What is the InChIKey of 6-(3,4-dihydro-2H-quinolin-1-yl)-N-methylpyridine-3-carboxamide?
The InChIKey is NISMXIATTZGOKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O/c1-17-16(20)13-8-9-15(18-11-13)19-10-4-6-12-5-2-3-7-14(12)19/h2-3,5,7-9,11H,4,6,10H2,1H3,(H,17,20).
What are the key properties of 6-(3,4-dihydro-2H-quinolin-1-yl)-N-methylpyridine-3-carboxamide?
6-(3,4-dihydro-2H-quinolin-1-yl)-N-methylpyridine-3-carboxamide has a molecular weight of 267.33 g/mol, XLogP of 2.53, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,4-dihydro-2H-quinolin-1-yl)-N-methylpyridine-3-carboxamide is sourced from PubChem (CID 84570471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).