4-[3-(4-methyl-1,2-oxazol-3-yl)azetidin-1-yl]-1H-1,8-naphthyridin-2-one

C15H14N4O2 — CID 146150335

IUPAC4-[3-(4-methyl-1,2-oxazol-3-yl)azetidin-1-yl]-1H-1,8-naphthyridin-2-one
SMILESCc1conc1C1CN(c2cc(=O)[nH]c3ncccc23)C1
InChIInChI=1S/C15H14N4O2/c1-9-8-21-18-14(9)10-6-19(7-10)12-5-13(20)17-15-11(12)3-2-4-16-15/h2-5,8,10H,6-7H2,1H3,(H,16,17,20)
InChIKeyXBDQPMWDQDXEEE-UHFFFAOYSA-N
MW282.30 g/mol
LogP1.82
Rot. Bonds2

About 4-[3-(4-methyl-1,2-oxazol-3-yl)azetidin-1-yl]-1H-1,8-naphthyridin-2-one

4-[3-(4-methyl-1,2-oxazol-3-yl)azetidin-1-yl]-1H-1,8-naphthyridin-2-one (PubChem CID 146150335) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is 4-[3-(4-methyl-1,2-oxazol-3-yl)azetidin-1-yl]-1H-1,8-naphthyridin-2-one.

Molecular Properties

Compound Name4-[3-(4-methyl-1,2-oxazol-3-yl)azetidin-1-yl]-1H-1,8-naphthyridin-2-one
PubChem CID146150335
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC Name4-[3-(4-methyl-1,2-oxazol-3-yl)azetidin-1-yl]-1H-1,8-naphthyridin-2-one
SMILESCc1conc1C1CN(c2cc(=O)[nH]c3ncccc23)C1
InChIInChI=1S/C15H14N4O2/c1-9-8-21-18-14(9)10-6-19(7-10)12-5-13(20)17-15-11(12)3-2-4-16-15/h2-5,8,10H,6-7H2,1H3,(H,16,17,20)
InChIKeyXBDQPMWDQDXEEE-UHFFFAOYSA-N
XLogP1.82
TPSA75.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[3-(4-methyl-1,2-oxazol-3-yl)azetidin-1-yl]-1H-1,8-naphthyridin-2-one?
The IUPAC name of 4-[3-(4-methyl-1,2-oxazol-3-yl)azetidin-1-yl]-1H-1,8-naphthyridin-2-one (CID 146150335) is 4-[3-(4-methyl-1,2-oxazol-3-yl)azetidin-1-yl]-1H-1,8-naphthyridin-2-one.
What is the SMILES notation for 4-[3-(4-methyl-1,2-oxazol-3-yl)azetidin-1-yl]-1H-1,8-naphthyridin-2-one?
The canonical SMILES for 4-[3-(4-methyl-1,2-oxazol-3-yl)azetidin-1-yl]-1H-1,8-naphthyridin-2-one is Cc1conc1C1CN(c2cc(=O)[nH]c3ncccc23)C1.
What is the InChIKey of 4-[3-(4-methyl-1,2-oxazol-3-yl)azetidin-1-yl]-1H-1,8-naphthyridin-2-one?
The InChIKey is XBDQPMWDQDXEEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c1-9-8-21-18-14(9)10-6-19(7-10)12-5-13(20)17-15-11(12)3-2-4-16-15/h2-5,8,10H,6-7H2,1H3,(H,16,17,20).
What are the key properties of 4-[3-(4-methyl-1,2-oxazol-3-yl)azetidin-1-yl]-1H-1,8-naphthyridin-2-one?
4-[3-(4-methyl-1,2-oxazol-3-yl)azetidin-1-yl]-1H-1,8-naphthyridin-2-one has a molecular weight of 282.30 g/mol, XLogP of 1.82, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(4-methyl-1,2-oxazol-3-yl)azetidin-1-yl]-1H-1,8-naphthyridin-2-one is sourced from PubChem (CID 146150335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).