7-methoxy-1-[2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]ethyl]-1,5-naphthyridin-2-one

C23H28N4O3 — CID 127042369

IUPAC7-methoxy-1-[2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]ethyl]-1,5-naphthyridin-2-one
SMILESCOc1ccc(CN2CCN(CCn3c(=O)ccc4ncc(OC)cc43)CC2)cc1
InChIInChI=1S/C23H28N4O3/c1-29-19-5-3-18(4-6-19)17-26-11-9-25(10-12-26)13-14-27-22-15-20(30-2)16-24-21(22)7-8-23(27)28/h3-8,15-16H,9-14,17H2,1-2H3
InChIKeyTZFYNMOZAYRWPT-UHFFFAOYSA-N
MW408.50 g/mol
LogP2.23
Rot. Bonds7

About 7-methoxy-1-[2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]ethyl]-1,5-naphthyridin-2-one

7-methoxy-1-[2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]ethyl]-1,5-naphthyridin-2-one (PubChem CID 127042369) has the molecular formula C23H28N4O3 and a molecular weight of 408.50 g/mol. Its IUPAC name is 7-methoxy-1-[2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]ethyl]-1,5-naphthyridin-2-one.

Molecular Properties

Compound Name7-methoxy-1-[2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]ethyl]-1,5-naphthyridin-2-one
PubChem CID127042369
Molecular FormulaC23H28N4O3
Molecular Weight408.50 g/mol
Exact Mass408.22
IUPAC Name7-methoxy-1-[2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]ethyl]-1,5-naphthyridin-2-one
SMILESCOc1ccc(CN2CCN(CCn3c(=O)ccc4ncc(OC)cc43)CC2)cc1
InChIInChI=1S/C23H28N4O3/c1-29-19-5-3-18(4-6-19)17-26-11-9-25(10-12-26)13-14-27-22-15-20(30-2)16-24-21(22)7-8-23(27)28/h3-8,15-16H,9-14,17H2,1-2H3
InChIKeyTZFYNMOZAYRWPT-UHFFFAOYSA-N
XLogP2.23
TPSA59.83 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.50
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 7-methoxy-1-[2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]ethyl]-1,5-naphthyridin-2-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-methoxy-1-[2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]ethyl]-1,5-naphthyridin-2-one?
The IUPAC name of 7-methoxy-1-[2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]ethyl]-1,5-naphthyridin-2-one (CID 127042369) is 7-methoxy-1-[2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]ethyl]-1,5-naphthyridin-2-one.
What is the SMILES notation for 7-methoxy-1-[2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]ethyl]-1,5-naphthyridin-2-one?
The canonical SMILES for 7-methoxy-1-[2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]ethyl]-1,5-naphthyridin-2-one is COc1ccc(CN2CCN(CCn3c(=O)ccc4ncc(OC)cc43)CC2)cc1.
What is the InChIKey of 7-methoxy-1-[2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]ethyl]-1,5-naphthyridin-2-one?
The InChIKey is TZFYNMOZAYRWPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N4O3/c1-29-19-5-3-18(4-6-19)17-26-11-9-25(10-12-26)13-14-27-22-15-20(30-2)16-24-21(22)7-8-23(27)28/h3-8,15-16H,9-14,17H2,1-2H3.
What are the key properties of 7-methoxy-1-[2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]ethyl]-1,5-naphthyridin-2-one?
7-methoxy-1-[2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]ethyl]-1,5-naphthyridin-2-one has a molecular weight of 408.50 g/mol, XLogP of 2.23, 7 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-1-[2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]ethyl]-1,5-naphthyridin-2-one is sourced from PubChem (CID 127042369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).