N-[(Z)-(2-ethoxynaphthalen-1-yl)methylideneamino]-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide

C27H25N3O3 — CID 110523148

IUPACN-[(Z)-(2-ethoxynaphthalen-1-yl)methylideneamino]-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide
SMILESCCOc1ccc2ccccc2c1/C=N\NC(=O)c1cccn(Cc2cccc(C)c2)c1=O
InChIInChI=1S/C27H25N3O3/c1-3-33-25-14-13-21-10-4-5-11-22(21)24(25)17-28-29-26(31)23-12-7-15-30(27(23)32)18-20-9-6-8-19(2)16-20/h4-17H,3,18H2,1-2H3,(H,29,31)/b28-17-
InChIKeyCHJQIRZWPANBOT-QRQIAZFYSA-N
MW439.52 g/mol
LogP4.52
Rot. Bonds7

About N-[(Z)-(2-ethoxynaphthalen-1-yl)methylideneamino]-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide

N-[(Z)-(2-ethoxynaphthalen-1-yl)methylideneamino]-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide (PubChem CID 110523148) has the molecular formula C27H25N3O3 and a molecular weight of 439.52 g/mol. Its IUPAC name is N-[(Z)-(2-ethoxynaphthalen-1-yl)methylideneamino]-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(Z)-(2-ethoxynaphthalen-1-yl)methylideneamino]-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide
PubChem CID110523148
Molecular FormulaC27H25N3O3
Molecular Weight439.52 g/mol
Exact Mass439.19
IUPAC NameN-[(Z)-(2-ethoxynaphthalen-1-yl)methylideneamino]-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide
SMILESCCOc1ccc2ccccc2c1/C=N\NC(=O)c1cccn(Cc2cccc(C)c2)c1=O
InChIInChI=1S/C27H25N3O3/c1-3-33-25-14-13-21-10-4-5-11-22(21)24(25)17-28-29-26(31)23-12-7-15-30(27(23)32)18-20-9-6-8-19(2)16-20/h4-17H,3,18H2,1-2H3,(H,29,31)/b28-17-
InChIKeyCHJQIRZWPANBOT-QRQIAZFYSA-N
XLogP4.52
TPSA72.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500439.52
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-[(Z)-(2-ethoxynaphthalen-1-yl)methylideneamino]-1-[(3-methylphenyl)methyl]-2-oxopyridine-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

Related Compounds

N-[(Z)-(2-chloro-6-fluorophenyl)methylideneamino]-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 110523154
1-benzyl-N-[(Z)-(3-bromo-4-ethoxyphenyl)methylideneamino]-2-oxopyridine-3-carboxamide
CID 110523889
N-[(Z)-(3-chloro-4-ethoxyphenyl)methylideneamino]-1-[(4-methylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 110524027
N-[(Z)-(3-fluorophenyl)methylideneamino]-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 110523143
1-benzyl-N-[(Z)-(3-ethoxy-4-hydroxyphenyl)methylideneamino]-2-oxopyridine-3-carboxamide
CID 136874487
[4-[(Z)-[[1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carbonyl]hydrazinylidene]methyl]phenyl] acetate
CID 110523171
N-[(Z)-(3-ethoxy-4-methoxyphenyl)methylideneamino]-1-[(4-methylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 110523988
N-[(Z)-(3-ethoxy-2-hydroxyphenyl)methylideneamino]-1-[(4-methylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 136874500
N-[(Z)-(2-ethoxynaphthalen-1-yl)methylideneamino]-2-methylfuran-3-carboxamide
CID 9359476
1-[(3-chlorophenyl)methyl]-N-[(Z)-(3-ethoxyphenyl)methylideneamino]-2-oxopyridine-3-carboxamide
CID 110524328
N-[(Z)-(4-hydroxy-3-methoxy-5-nitrophenyl)methylideneamino]-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 136874370
1-[(4-methylphenyl)methyl]-2-oxo-N-[(Z)-(2-propoxyphenyl)methylideneamino]pyridine-3-carboxamide
CID 110524066

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-(2-ethoxynaphthalen-1-yl)methylideneamino]-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide?
The IUPAC name of N-[(Z)-(2-ethoxynaphthalen-1-yl)methylideneamino]-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide (CID 110523148) is N-[(Z)-(2-ethoxynaphthalen-1-yl)methylideneamino]-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide.
What is the SMILES notation for N-[(Z)-(2-ethoxynaphthalen-1-yl)methylideneamino]-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide?
The canonical SMILES for N-[(Z)-(2-ethoxynaphthalen-1-yl)methylideneamino]-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide is CCOc1ccc2ccccc2c1/C=N\NC(=O)c1cccn(Cc2cccc(C)c2)c1=O.
What is the InChIKey of N-[(Z)-(2-ethoxynaphthalen-1-yl)methylideneamino]-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide?
The InChIKey is CHJQIRZWPANBOT-QRQIAZFYSA-N. The full InChI is InChI=1S/C27H25N3O3/c1-3-33-25-14-13-21-10-4-5-11-22(21)24(25)17-28-29-26(31)23-12-7-15-30(27(23)32)18-20-9-6-8-19(2)16-20/h4-17H,3,18H2,1-2H3,(H,29,31)/b28-17-.
What are the key properties of N-[(Z)-(2-ethoxynaphthalen-1-yl)methylideneamino]-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide?
N-[(Z)-(2-ethoxynaphthalen-1-yl)methylideneamino]-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide has a molecular weight of 439.52 g/mol, XLogP of 4.52, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(2-ethoxynaphthalen-1-yl)methylideneamino]-1-[(3-methylphenyl)methyl]-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 110523148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).