7-[2-[4-(6-fluoro-5-methyl-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-5,6-dihydro-1,7-naphthyridin-8-one

C23H25FN4O2 — CID 146343630

IUPAC7-[2-[4-(6-fluoro-5-methyl-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-5,6-dihydro-1,7-naphthyridin-8-one
SMILESCc1cc2c(C3CCN(CCN4CCc5cccnc5C4=O)CC3)noc2cc1F
InChIInChI=1S/C23H25FN4O2/c1-15-13-18-20(14-19(15)24)30-26-21(18)17-4-8-27(9-5-17)11-12-28-10-6-16-3-2-7-25-22(16)23(28)29/h2-3,7,13-14,17H,4-6,8-12H2,1H3
InChIKeyGLZLCGJYIGNPRT-UHFFFAOYSA-N
MW408.48 g/mol
LogP3.55
Rot. Bonds4

About 7-[2-[4-(6-fluoro-5-methyl-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-5,6-dihydro-1,7-naphthyridin-8-one

7-[2-[4-(6-fluoro-5-methyl-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-5,6-dihydro-1,7-naphthyridin-8-one (PubChem CID 146343630) has the molecular formula C23H25FN4O2 and a molecular weight of 408.48 g/mol. Its IUPAC name is 7-[2-[4-(6-fluoro-5-methyl-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-5,6-dihydro-1,7-naphthyridin-8-one.

Molecular Properties

Compound Name7-[2-[4-(6-fluoro-5-methyl-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-5,6-dihydro-1,7-naphthyridin-8-one
PubChem CID146343630
Molecular FormulaC23H25FN4O2
Molecular Weight408.48 g/mol
Exact Mass408.20
IUPAC Name7-[2-[4-(6-fluoro-5-methyl-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-5,6-dihydro-1,7-naphthyridin-8-one
SMILESCc1cc2c(C3CCN(CCN4CCc5cccnc5C4=O)CC3)noc2cc1F
InChIInChI=1S/C23H25FN4O2/c1-15-13-18-20(14-19(15)24)30-26-21(18)17-4-8-27(9-5-17)11-12-28-10-6-16-3-2-7-25-22(16)23(28)29/h2-3,7,13-14,17H,4-6,8-12H2,1H3
InChIKeyGLZLCGJYIGNPRT-UHFFFAOYSA-N
XLogP3.55
TPSA62.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.48
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 7-[2-[4-(6-fluoro-5-methyl-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-5,6-dihydro-1,7-naphthyridin-8-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-[2-[4-(6-fluoro-5-methyl-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-5,6-dihydro-1,7-naphthyridin-8-one?
The IUPAC name of 7-[2-[4-(6-fluoro-5-methyl-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-5,6-dihydro-1,7-naphthyridin-8-one (CID 146343630) is 7-[2-[4-(6-fluoro-5-methyl-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-5,6-dihydro-1,7-naphthyridin-8-one.
What is the SMILES notation for 7-[2-[4-(6-fluoro-5-methyl-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-5,6-dihydro-1,7-naphthyridin-8-one?
The canonical SMILES for 7-[2-[4-(6-fluoro-5-methyl-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-5,6-dihydro-1,7-naphthyridin-8-one is Cc1cc2c(C3CCN(CCN4CCc5cccnc5C4=O)CC3)noc2cc1F.
What is the InChIKey of 7-[2-[4-(6-fluoro-5-methyl-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-5,6-dihydro-1,7-naphthyridin-8-one?
The InChIKey is GLZLCGJYIGNPRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25FN4O2/c1-15-13-18-20(14-19(15)24)30-26-21(18)17-4-8-27(9-5-17)11-12-28-10-6-16-3-2-7-25-22(16)23(28)29/h2-3,7,13-14,17H,4-6,8-12H2,1H3.
What are the key properties of 7-[2-[4-(6-fluoro-5-methyl-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-5,6-dihydro-1,7-naphthyridin-8-one?
7-[2-[4-(6-fluoro-5-methyl-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-5,6-dihydro-1,7-naphthyridin-8-one has a molecular weight of 408.48 g/mol, XLogP of 3.55, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[2-[4-(6-fluoro-5-methyl-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-5,6-dihydro-1,7-naphthyridin-8-one is sourced from PubChem (CID 146343630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).