6-(5-cyclobutyl-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-1,8-naphthyridin-2-one

C22H23N3O2 — CID 156524479

IUPAC6-(5-cyclobutyl-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-1,8-naphthyridin-2-one
SMILESO=C1CCc2cc(C(=O)N3CCCc4c(C5CCC5)cccc43)cnc2N1
InChIInChI=1S/C22H23N3O2/c26-20-10-9-15-12-16(13-23-21(15)24-20)22(27)25-11-3-7-18-17(14-4-1-5-14)6-2-8-19(18)25/h2,6,8,12-14H,1,3-5,7,9-11H2,(H,23,24,26)
InChIKeyKHUINBUGBWYKCD-UHFFFAOYSA-N
MW361.45 g/mol
LogP3.83
Rot. Bonds2

About 6-(5-cyclobutyl-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-1,8-naphthyridin-2-one

6-(5-cyclobutyl-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-1,8-naphthyridin-2-one (PubChem CID 156524479) has the molecular formula C22H23N3O2 and a molecular weight of 361.45 g/mol. Its IUPAC name is 6-(5-cyclobutyl-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-1,8-naphthyridin-2-one.

Molecular Properties

Compound Name6-(5-cyclobutyl-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-1,8-naphthyridin-2-one
PubChem CID156524479
Molecular FormulaC22H23N3O2
Molecular Weight361.45 g/mol
Exact Mass361.18
IUPAC Name6-(5-cyclobutyl-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-1,8-naphthyridin-2-one
SMILESO=C1CCc2cc(C(=O)N3CCCc4c(C5CCC5)cccc43)cnc2N1
InChIInChI=1S/C22H23N3O2/c26-20-10-9-15-12-16(13-23-21(15)24-20)22(27)25-11-3-7-18-17(14-4-1-5-14)6-2-8-19(18)25/h2,6,8,12-14H,1,3-5,7,9-11H2,(H,23,24,26)
InChIKeyKHUINBUGBWYKCD-UHFFFAOYSA-N
XLogP3.83
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.45
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-(5-cyclobutyl-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-1,8-naphthyridin-2-one with MolForge

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Related Compounds

2-[1-(7-oxo-6,8-dihydro-5H-1,8-naphthyridine-3-carbonyl)piperidin-4-yl]acetic acid
CID 166296162
2-tert-butyl-3-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-3-yl)but-2-enoic acid
CID 66905252
3,4-dihydro-2H-quinolin-1-yl-[2-(4-methylpiperidin-1-yl)pyrimidin-5-yl]methanone
CID 109250910
6-[3-[4-(3-hydroxyphenyl)piperidin-1-yl]-3-oxoprop-1-enyl]-3,4-dihydro-1H-1,8-naphthyridin-2-one
CID 78056430
(5R)-5-(5-amino-3,4-dihydro-2H-quinoline-1-carbonyl)pyrrolidin-2-one
CID 103866804
[5-(cyclopropylamino)-3-pyridinyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 109223845
[6-(2,6-difluoroanilino)-3-pyridinyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 109162542
6-[3-(azetidin-1-yl)-3-oxoprop-1-enyl]-3,4-dihydro-1H-1,8-naphthyridin-2-one
CID 70926898
3,4-dihydro-2H-quinolin-1-yl-(6-fluoro-3-pyridinyl)methanone
CID 63972350
[2-(3,4-dihydro-2H-quinoline-1-carbonyl)-4-pyridinyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 109091635
6-[(E)-3-(1,3,4,5,5a,10a-hexahydro-[1]benzofuro[2,3-c]azepin-2-yl)-3-oxoprop-1-enyl]-3,4-dihydro-1H-1,8-naphthyridin-2-one
CID 176873849
[5-(3,6-diazabicyclo[3.1.1]heptan-3-yl)-3-pyridinyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 155561319

Frequently Asked Questions

What is the IUPAC name of 6-(5-cyclobutyl-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-1,8-naphthyridin-2-one?
The IUPAC name of 6-(5-cyclobutyl-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-1,8-naphthyridin-2-one (CID 156524479) is 6-(5-cyclobutyl-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-1,8-naphthyridin-2-one.
What is the SMILES notation for 6-(5-cyclobutyl-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-1,8-naphthyridin-2-one?
The canonical SMILES for 6-(5-cyclobutyl-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-1,8-naphthyridin-2-one is O=C1CCc2cc(C(=O)N3CCCc4c(C5CCC5)cccc43)cnc2N1.
What is the InChIKey of 6-(5-cyclobutyl-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-1,8-naphthyridin-2-one?
The InChIKey is KHUINBUGBWYKCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O2/c26-20-10-9-15-12-16(13-23-21(15)24-20)22(27)25-11-3-7-18-17(14-4-1-5-14)6-2-8-19(18)25/h2,6,8,12-14H,1,3-5,7,9-11H2,(H,23,24,26).
What are the key properties of 6-(5-cyclobutyl-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-1,8-naphthyridin-2-one?
6-(5-cyclobutyl-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-1,8-naphthyridin-2-one has a molecular weight of 361.45 g/mol, XLogP of 3.83, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-cyclobutyl-3,4-dihydro-2H-quinoline-1-carbonyl)-3,4-dihydro-1H-1,8-naphthyridin-2-one is sourced from PubChem (CID 156524479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).