5-[2-(4-hydroxyphenyl)acetyl]-N-(6-methoxy-3-pyridinyl)-7,8-dihydro-6H-1,5-naphthyridine-3-carboxamide

C23H22N4O4 — CID 134807065

IUPAC5-[2-(4-hydroxyphenyl)acetyl]-N-(6-methoxy-3-pyridinyl)-7,8-dihydro-6H-1,5-naphthyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2cnc3c(c2)N(C(=O)Cc2ccc(O)cc2)CCC3)cn1
InChIInChI=1S/C23H22N4O4/c1-31-21-9-6-17(14-25-21)26-23(30)16-12-20-19(24-13-16)3-2-10-27(20)22(29)11-15-4-7-18(28)8-5-15/h4-9,12-14,28H,2-3,10-11H2,1H3,(H,26,30)
InChIKeyCLQLHKTUZJDKKP-UHFFFAOYSA-N
MW418.45 g/mol
LogP2.96
Rot. Bonds5

About 5-[2-(4-hydroxyphenyl)acetyl]-N-(6-methoxy-3-pyridinyl)-7,8-dihydro-6H-1,5-naphthyridine-3-carboxamide

5-[2-(4-hydroxyphenyl)acetyl]-N-(6-methoxy-3-pyridinyl)-7,8-dihydro-6H-1,5-naphthyridine-3-carboxamide (PubChem CID 134807065) has the molecular formula C23H22N4O4 and a molecular weight of 418.45 g/mol. Its IUPAC name is 5-[2-(4-hydroxyphenyl)acetyl]-N-(6-methoxy-3-pyridinyl)-7,8-dihydro-6H-1,5-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name5-[2-(4-hydroxyphenyl)acetyl]-N-(6-methoxy-3-pyridinyl)-7,8-dihydro-6H-1,5-naphthyridine-3-carboxamide
PubChem CID134807065
Molecular FormulaC23H22N4O4
Molecular Weight418.45 g/mol
Exact Mass418.16
IUPAC Name5-[2-(4-hydroxyphenyl)acetyl]-N-(6-methoxy-3-pyridinyl)-7,8-dihydro-6H-1,5-naphthyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2cnc3c(c2)N(C(=O)Cc2ccc(O)cc2)CCC3)cn1
InChIInChI=1S/C23H22N4O4/c1-31-21-9-6-17(14-25-21)26-23(30)16-12-20-19(24-13-16)3-2-10-27(20)22(29)11-15-4-7-18(28)8-5-15/h4-9,12-14,28H,2-3,10-11H2,1H3,(H,26,30)
InChIKeyCLQLHKTUZJDKKP-UHFFFAOYSA-N
XLogP2.96
TPSA104.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.45
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 5-[2-(4-hydroxyphenyl)acetyl]-N-(6-methoxy-3-pyridinyl)-7,8-dihydro-6H-1,5-naphthyridine-3-carboxamide 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 5-[2-(4-hydroxyphenyl)acetyl]-N-(6-methoxy-3-pyridinyl)-7,8-dihydro-6H-1,5-naphthyridine-3-carboxamide?
The IUPAC name of 5-[2-(4-hydroxyphenyl)acetyl]-N-(6-methoxy-3-pyridinyl)-7,8-dihydro-6H-1,5-naphthyridine-3-carboxamide (CID 134807065) is 5-[2-(4-hydroxyphenyl)acetyl]-N-(6-methoxy-3-pyridinyl)-7,8-dihydro-6H-1,5-naphthyridine-3-carboxamide.
What is the SMILES notation for 5-[2-(4-hydroxyphenyl)acetyl]-N-(6-methoxy-3-pyridinyl)-7,8-dihydro-6H-1,5-naphthyridine-3-carboxamide?
The canonical SMILES for 5-[2-(4-hydroxyphenyl)acetyl]-N-(6-methoxy-3-pyridinyl)-7,8-dihydro-6H-1,5-naphthyridine-3-carboxamide is COc1ccc(NC(=O)c2cnc3c(c2)N(C(=O)Cc2ccc(O)cc2)CCC3)cn1.
What is the InChIKey of 5-[2-(4-hydroxyphenyl)acetyl]-N-(6-methoxy-3-pyridinyl)-7,8-dihydro-6H-1,5-naphthyridine-3-carboxamide?
The InChIKey is CLQLHKTUZJDKKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O4/c1-31-21-9-6-17(14-25-21)26-23(30)16-12-20-19(24-13-16)3-2-10-27(20)22(29)11-15-4-7-18(28)8-5-15/h4-9,12-14,28H,2-3,10-11H2,1H3,(H,26,30).
What are the key properties of 5-[2-(4-hydroxyphenyl)acetyl]-N-(6-methoxy-3-pyridinyl)-7,8-dihydro-6H-1,5-naphthyridine-3-carboxamide?
5-[2-(4-hydroxyphenyl)acetyl]-N-(6-methoxy-3-pyridinyl)-7,8-dihydro-6H-1,5-naphthyridine-3-carboxamide has a molecular weight of 418.45 g/mol, XLogP of 2.96, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(4-hydroxyphenyl)acetyl]-N-(6-methoxy-3-pyridinyl)-7,8-dihydro-6H-1,5-naphthyridine-3-carboxamide is sourced from PubChem (CID 134807065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).