N-[2-(4-methylphenoxy)phenyl]-3-(4-oxocinnolin-1-yl)propanamide

C24H21N3O3 — CID 51254853

IUPACN-[2-(4-methylphenoxy)phenyl]-3-(4-oxocinnolin-1-yl)propanamide
SMILESCc1ccc(Oc2ccccc2NC(=O)CCn2ncc(=O)c3ccccc32)cc1
InChIInChI=1S/C24H21N3O3/c1-17-10-12-18(13-11-17)30-23-9-5-3-7-20(23)26-24(29)14-15-27-21-8-4-2-6-19(21)22(28)16-25-27/h2-13,16H,14-15H2,1H3,(H,26,29)
InChIKeyPYAYCFQQNNIMGN-UHFFFAOYSA-N
MW399.45 g/mol
LogP4.53
Rot. Bonds6

About N-[2-(4-methylphenoxy)phenyl]-3-(4-oxocinnolin-1-yl)propanamide

N-[2-(4-methylphenoxy)phenyl]-3-(4-oxocinnolin-1-yl)propanamide (PubChem CID 51254853) has the molecular formula C24H21N3O3 and a molecular weight of 399.45 g/mol. Its IUPAC name is N-[2-(4-methylphenoxy)phenyl]-3-(4-oxocinnolin-1-yl)propanamide.

Molecular Properties

Compound NameN-[2-(4-methylphenoxy)phenyl]-3-(4-oxocinnolin-1-yl)propanamide
PubChem CID51254853
Molecular FormulaC24H21N3O3
Molecular Weight399.45 g/mol
Exact Mass399.16
IUPAC NameN-[2-(4-methylphenoxy)phenyl]-3-(4-oxocinnolin-1-yl)propanamide
SMILESCc1ccc(Oc2ccccc2NC(=O)CCn2ncc(=O)c3ccccc32)cc1
InChIInChI=1S/C24H21N3O3/c1-17-10-12-18(13-11-17)30-23-9-5-3-7-20(23)26-24(29)14-15-27-21-8-4-2-6-19(21)22(28)16-25-27/h2-13,16H,14-15H2,1H3,(H,26,29)
InChIKeyPYAYCFQQNNIMGN-UHFFFAOYSA-N
XLogP4.53
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.45
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[2-(4-methylphenoxy)phenyl]-3-(4-oxocinnolin-1-yl)propanamide 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-(3-chloro-2-methylphenyl)-3-(4-oxocinnolin-1-yl)propanamide
CID 51254629
N-(2-tert-butylphenyl)-3-(4-oxocinnolin-1-yl)propanamide
CID 134015345
3-(1-methyl-4-oxopyrazolo[5,4-d]pyrimidin-5-yl)-N-[2-(4-methylphenoxy)phenyl]propanamide
CID 16595195
N-(4-iodo-2-methylphenyl)-3-(4-oxocinnolin-1-yl)propanamide
CID 55439085
N-(4-chloro-2-methylphenyl)-3-(4-oxocinnolin-1-yl)propanamide
CID 18097739
N-[2-(4-methylphenoxy)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide
CID 27147986
3-(4-oxocinnolin-1-yl)-N-[4-(trifluoromethoxy)phenyl]propanamide
CID 18097743
N-(2-methoxy-4-methylphenyl)-2-(4-oxocinnolin-1-yl)acetamide
CID 87028673
3-fluoro-4-methyl-5-[3-(4-oxocinnolin-1-yl)propanoylamino]benzamide
CID 87001719
3-(4-oxocinnolin-1-yl)-N-propan-2-ylpropanamide
CID 47123641
N-(4-acetylphenyl)-3-(4-oxocinnolin-1-yl)propanamide
CID 18097698
N-(3-acetamidophenyl)-3-(4-oxocinnolin-1-yl)propanamide
CID 51254626

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methylphenoxy)phenyl]-3-(4-oxocinnolin-1-yl)propanamide?
The IUPAC name of N-[2-(4-methylphenoxy)phenyl]-3-(4-oxocinnolin-1-yl)propanamide (CID 51254853) is N-[2-(4-methylphenoxy)phenyl]-3-(4-oxocinnolin-1-yl)propanamide.
What is the SMILES notation for N-[2-(4-methylphenoxy)phenyl]-3-(4-oxocinnolin-1-yl)propanamide?
The canonical SMILES for N-[2-(4-methylphenoxy)phenyl]-3-(4-oxocinnolin-1-yl)propanamide is Cc1ccc(Oc2ccccc2NC(=O)CCn2ncc(=O)c3ccccc32)cc1.
What is the InChIKey of N-[2-(4-methylphenoxy)phenyl]-3-(4-oxocinnolin-1-yl)propanamide?
The InChIKey is PYAYCFQQNNIMGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O3/c1-17-10-12-18(13-11-17)30-23-9-5-3-7-20(23)26-24(29)14-15-27-21-8-4-2-6-19(21)22(28)16-25-27/h2-13,16H,14-15H2,1H3,(H,26,29).
What are the key properties of N-[2-(4-methylphenoxy)phenyl]-3-(4-oxocinnolin-1-yl)propanamide?
N-[2-(4-methylphenoxy)phenyl]-3-(4-oxocinnolin-1-yl)propanamide has a molecular weight of 399.45 g/mol, XLogP of 4.53, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methylphenoxy)phenyl]-3-(4-oxocinnolin-1-yl)propanamide is sourced from PubChem (CID 51254853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).