6-[3-(3,4-dihydro-2H-quinolin-1-yl)propylamino]-N,N-dimethylpyridine-3-carboxamide

C20H26N4O — CID 135114633

IUPAC6-[3-(3,4-dihydro-2H-quinolin-1-yl)propylamino]-N,N-dimethylpyridine-3-carboxamide
SMILESCN(C)C(=O)c1ccc(NCCCN2CCCc3ccccc32)nc1
InChIInChI=1S/C20H26N4O/c1-23(2)20(25)17-10-11-19(22-15-17)21-12-6-14-24-13-5-8-16-7-3-4-9-18(16)24/h3-4,7,9-11,15H,5-6,8,12-14H2,1-2H3,(H,21,22)
InChIKeyWUNWUWWJNPDXLR-UHFFFAOYSA-N
MW338.46 g/mol
LogP3.04
Rot. Bonds6

About 6-[3-(3,4-dihydro-2H-quinolin-1-yl)propylamino]-N,N-dimethylpyridine-3-carboxamide

6-[3-(3,4-dihydro-2H-quinolin-1-yl)propylamino]-N,N-dimethylpyridine-3-carboxamide (PubChem CID 135114633) has the molecular formula C20H26N4O and a molecular weight of 338.46 g/mol. Its IUPAC name is 6-[3-(3,4-dihydro-2H-quinolin-1-yl)propylamino]-N,N-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-[3-(3,4-dihydro-2H-quinolin-1-yl)propylamino]-N,N-dimethylpyridine-3-carboxamide
PubChem CID135114633
Molecular FormulaC20H26N4O
Molecular Weight338.46 g/mol
Exact Mass338.21
IUPAC Name6-[3-(3,4-dihydro-2H-quinolin-1-yl)propylamino]-N,N-dimethylpyridine-3-carboxamide
SMILESCN(C)C(=O)c1ccc(NCCCN2CCCc3ccccc32)nc1
InChIInChI=1S/C20H26N4O/c1-23(2)20(25)17-10-11-19(22-15-17)21-12-6-14-24-13-5-8-16-7-3-4-9-18(16)24/h3-4,7,9-11,15H,5-6,8,12-14H2,1-2H3,(H,21,22)
InChIKeyWUNWUWWJNPDXLR-UHFFFAOYSA-N
XLogP3.04
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.46
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[3-(2,3-dihydroindol-1-yl)propyl]-5-nitropyridin-2-amine
CID 34058867
6-(6-hydroxyhexylamino)-N,N-dimethylpyridine-3-carboxamide
CID 103918113
N-[3-(3,4-dihydro-2H-quinolin-1-yl)propyl]-1-methyl-3-propan-2-ylpyrazole-5-carboxamide
CID 46963655
3,4-dihydro-2H-quinolin-1-yl-[6-(ethylamino)-3-pyridinyl]methanone
CID 62172128
N,N-dimethyl-6-(5,5,5-trifluoropentylamino)pyridine-3-carboxamide
CID 115486588
4-(3,4-dihydro-2H-quinolin-1-yl)-N-methylbutan-1-amine
CID 60840995
6-(3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethylhexan-1-amine
CID 13472124
8-(3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethyloctan-1-amine
CID 13472133
tert-butyl N-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]carbamate
CID 112757446
6-[2-(cyclopenten-1-yl)ethylamino]-N,N-dimethylpyridine-3-carboxamide
CID 103844277
2-amino-N-[3-(2,3-dihydroindol-1-yl)propyl]-2-methylpropanamide
CID 61264292
1-[3-(3,4-dihydro-2H-quinolin-1-yl)propyl]-3-(3,5-dimethylphenyl)urea
CID 23609343

Frequently Asked Questions

What is the IUPAC name of 6-[3-(3,4-dihydro-2H-quinolin-1-yl)propylamino]-N,N-dimethylpyridine-3-carboxamide?
The IUPAC name of 6-[3-(3,4-dihydro-2H-quinolin-1-yl)propylamino]-N,N-dimethylpyridine-3-carboxamide (CID 135114633) is 6-[3-(3,4-dihydro-2H-quinolin-1-yl)propylamino]-N,N-dimethylpyridine-3-carboxamide.
What is the SMILES notation for 6-[3-(3,4-dihydro-2H-quinolin-1-yl)propylamino]-N,N-dimethylpyridine-3-carboxamide?
The canonical SMILES for 6-[3-(3,4-dihydro-2H-quinolin-1-yl)propylamino]-N,N-dimethylpyridine-3-carboxamide is CN(C)C(=O)c1ccc(NCCCN2CCCc3ccccc32)nc1.
What is the InChIKey of 6-[3-(3,4-dihydro-2H-quinolin-1-yl)propylamino]-N,N-dimethylpyridine-3-carboxamide?
The InChIKey is WUNWUWWJNPDXLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O/c1-23(2)20(25)17-10-11-19(22-15-17)21-12-6-14-24-13-5-8-16-7-3-4-9-18(16)24/h3-4,7,9-11,15H,5-6,8,12-14H2,1-2H3,(H,21,22).
What are the key properties of 6-[3-(3,4-dihydro-2H-quinolin-1-yl)propylamino]-N,N-dimethylpyridine-3-carboxamide?
6-[3-(3,4-dihydro-2H-quinolin-1-yl)propylamino]-N,N-dimethylpyridine-3-carboxamide has a molecular weight of 338.46 g/mol, XLogP of 3.04, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(3,4-dihydro-2H-quinolin-1-yl)propylamino]-N,N-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 135114633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).