1-(2-methylquinolin-4-yl)-3,4-dihydro-2H-1,6-naphthyridine

C18H17N3 — CID 58820209

IUPAC1-(2-methylquinolin-4-yl)-3,4-dihydro-2H-1,6-naphthyridine
SMILESCc1cc(N2CCCc3cnccc32)c2ccccc2n1
InChIInChI=1S/C18H17N3/c1-13-11-18(15-6-2-3-7-16(15)20-13)21-10-4-5-14-12-19-9-8-17(14)21/h2-3,6-9,11-12H,4-5,10H2,1H3
InChIKeyHATVTRZBMRLOJQ-UHFFFAOYSA-N
MW275.36 g/mol
LogP4.02
Rot. Bonds1

About 1-(2-methylquinolin-4-yl)-3,4-dihydro-2H-1,6-naphthyridine

1-(2-methylquinolin-4-yl)-3,4-dihydro-2H-1,6-naphthyridine (PubChem CID 58820209) has the molecular formula C18H17N3 and a molecular weight of 275.36 g/mol. Its IUPAC name is 1-(2-methylquinolin-4-yl)-3,4-dihydro-2H-1,6-naphthyridine.

Molecular Properties

Compound Name1-(2-methylquinolin-4-yl)-3,4-dihydro-2H-1,6-naphthyridine
PubChem CID58820209
Molecular FormulaC18H17N3
Molecular Weight275.36 g/mol
Exact Mass275.14
IUPAC Name1-(2-methylquinolin-4-yl)-3,4-dihydro-2H-1,6-naphthyridine
SMILESCc1cc(N2CCCc3cnccc32)c2ccccc2n1
InChIInChI=1S/C18H17N3/c1-13-11-18(15-6-2-3-7-16(15)20-13)21-10-4-5-14-12-19-9-8-17(14)21/h2-3,6-9,11-12H,4-5,10H2,1H3
InChIKeyHATVTRZBMRLOJQ-UHFFFAOYSA-N
XLogP4.02
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

CID 169429844
CID 169429844
4-imidazo[4,5-c]pyridin-1-yl-2-methylquinoline
CID 58820211
1-methyl-3,4-dihydro-2H-1,6-naphthyridine
CID 45079501
2-methyl-4-piperazin-1-ylquinoline;hydrochloride
CID 17040066
4-[2-(chloromethyl)pyrrolidin-1-yl]-2-methylquinoline
CID 55184612
cyclobutanecarboxylic acid;2-methyl-4-pyrrolidin-1-ylquinoline
CID 158504598
4-(2,3-dihydroindol-1-yl)-2-phenylquinoline
CID 91742521
4-methyl-1-(2-methylquinolin-4-yl)pyrrole-3-carboxylic acid
CID 22024945
(2-methylquinolin-4-yl)-(6-methylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 60530096
[1-(2-methylquinolin-4-yl)piperidin-2-yl]methanol
CID 60716376
N,4-dimethyl-1-(2-methylquinolin-4-yl)piperidin-4-amine
CID 115305596
4-[4-(2-chloroethyl)piperazin-1-yl]-2-methylquinoline
CID 63392682

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylquinolin-4-yl)-3,4-dihydro-2H-1,6-naphthyridine?
The IUPAC name of 1-(2-methylquinolin-4-yl)-3,4-dihydro-2H-1,6-naphthyridine (CID 58820209) is 1-(2-methylquinolin-4-yl)-3,4-dihydro-2H-1,6-naphthyridine.
What is the SMILES notation for 1-(2-methylquinolin-4-yl)-3,4-dihydro-2H-1,6-naphthyridine?
The canonical SMILES for 1-(2-methylquinolin-4-yl)-3,4-dihydro-2H-1,6-naphthyridine is Cc1cc(N2CCCc3cnccc32)c2ccccc2n1.
What is the InChIKey of 1-(2-methylquinolin-4-yl)-3,4-dihydro-2H-1,6-naphthyridine?
The InChIKey is HATVTRZBMRLOJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3/c1-13-11-18(15-6-2-3-7-16(15)20-13)21-10-4-5-14-12-19-9-8-17(14)21/h2-3,6-9,11-12H,4-5,10H2,1H3.
What are the key properties of 1-(2-methylquinolin-4-yl)-3,4-dihydro-2H-1,6-naphthyridine?
1-(2-methylquinolin-4-yl)-3,4-dihydro-2H-1,6-naphthyridine has a molecular weight of 275.36 g/mol, XLogP of 4.02, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylquinolin-4-yl)-3,4-dihydro-2H-1,6-naphthyridine is sourced from PubChem (CID 58820209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).