1-[(2-fluorophenyl)methyl]-3-(morpholine-4-carbonyl)-1,8-naphthyridin-2-one

C20H18FN3O3 — CID 7620895

IUPAC1-[(2-fluorophenyl)methyl]-3-(morpholine-4-carbonyl)-1,8-naphthyridin-2-one
SMILESO=C(c1cc2cccnc2n(Cc2ccccc2F)c1=O)N1CCOCC1
InChIInChI=1S/C20H18FN3O3/c21-17-6-2-1-4-15(17)13-24-18-14(5-3-7-22-18)12-16(20(24)26)19(25)23-8-10-27-11-9-23/h1-7,12H,8-11,13H2
InChIKeySTHZCCCUBLLWDQ-UHFFFAOYSA-N
MW367.38 g/mol
LogP2.06
Rot. Bonds3

About 1-[(2-fluorophenyl)methyl]-3-(morpholine-4-carbonyl)-1,8-naphthyridin-2-one

1-[(2-fluorophenyl)methyl]-3-(morpholine-4-carbonyl)-1,8-naphthyridin-2-one (PubChem CID 7620895) has the molecular formula C20H18FN3O3 and a molecular weight of 367.38 g/mol. Its IUPAC name is 1-[(2-fluorophenyl)methyl]-3-(morpholine-4-carbonyl)-1,8-naphthyridin-2-one.

Molecular Properties

Compound Name1-[(2-fluorophenyl)methyl]-3-(morpholine-4-carbonyl)-1,8-naphthyridin-2-one
PubChem CID7620895
Molecular FormulaC20H18FN3O3
Molecular Weight367.38 g/mol
Exact Mass367.13
IUPAC Name1-[(2-fluorophenyl)methyl]-3-(morpholine-4-carbonyl)-1,8-naphthyridin-2-one
SMILESO=C(c1cc2cccnc2n(Cc2ccccc2F)c1=O)N1CCOCC1
InChIInChI=1S/C20H18FN3O3/c21-17-6-2-1-4-15(17)13-24-18-14(5-3-7-22-18)12-16(20(24)26)19(25)23-8-10-27-11-9-23/h1-7,12H,8-11,13H2
InChIKeySTHZCCCUBLLWDQ-UHFFFAOYSA-N
XLogP2.06
TPSA64.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.38
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(2-fluorophenyl)methyl]-3-(4-methylpiperazine-1-carbonyl)-1,8-naphthyridin-2-one
CID 7620901
3-(4-benzylpiperidine-1-carbonyl)-1-[(2-fluorophenyl)methyl]-1,8-naphthyridin-2-one
CID 43996144
1-[(2-fluorophenyl)methyl]-2-oxo-N,N-di(propan-2-yl)-1,8-naphthyridine-3-carboxamide
CID 7620857
N,N-dicyclohexyl-1-[(2-fluorophenyl)methyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 43996135
3-(azepane-1-carbonyl)-1-[(4-fluorophenyl)methyl]-1,8-naphthyridin-2-one
CID 7620629
N-ethyl-1-[(2-fluorophenyl)methyl]-2-oxo-N-phenyl-1,8-naphthyridine-3-carboxamide
CID 43996164
1-[(2-fluorophenyl)methyl]-N-(1,2-oxazol-3-yl)-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7621078
1-[(2-fluorophenyl)methyl]-N-(4-methylphenyl)-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7621018
1-[(2-fluorophenyl)methyl]-N-octyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 43996215
1-[(2-fluorophenyl)methyl]-2-oxo-N-[(1R)-1-phenylethyl]-1,8-naphthyridine-3-carboxamide
CID 7620990
1-[(2-fluorophenyl)methyl]-N-[(1R,2S)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7620975
1-[(2-fluorophenyl)methyl]-N-[(1R,2R)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7620974

Frequently Asked Questions

What is the IUPAC name of 1-[(2-fluorophenyl)methyl]-3-(morpholine-4-carbonyl)-1,8-naphthyridin-2-one?
The IUPAC name of 1-[(2-fluorophenyl)methyl]-3-(morpholine-4-carbonyl)-1,8-naphthyridin-2-one (CID 7620895) is 1-[(2-fluorophenyl)methyl]-3-(morpholine-4-carbonyl)-1,8-naphthyridin-2-one.
What is the SMILES notation for 1-[(2-fluorophenyl)methyl]-3-(morpholine-4-carbonyl)-1,8-naphthyridin-2-one?
The canonical SMILES for 1-[(2-fluorophenyl)methyl]-3-(morpholine-4-carbonyl)-1,8-naphthyridin-2-one is O=C(c1cc2cccnc2n(Cc2ccccc2F)c1=O)N1CCOCC1.
What is the InChIKey of 1-[(2-fluorophenyl)methyl]-3-(morpholine-4-carbonyl)-1,8-naphthyridin-2-one?
The InChIKey is STHZCCCUBLLWDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN3O3/c21-17-6-2-1-4-15(17)13-24-18-14(5-3-7-22-18)12-16(20(24)26)19(25)23-8-10-27-11-9-23/h1-7,12H,8-11,13H2.
What are the key properties of 1-[(2-fluorophenyl)methyl]-3-(morpholine-4-carbonyl)-1,8-naphthyridin-2-one?
1-[(2-fluorophenyl)methyl]-3-(morpholine-4-carbonyl)-1,8-naphthyridin-2-one has a molecular weight of 367.38 g/mol, XLogP of 2.06, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-fluorophenyl)methyl]-3-(morpholine-4-carbonyl)-1,8-naphthyridin-2-one is sourced from PubChem (CID 7620895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).