N-(4-methyl-2-propoxyphenyl)-3-(4-oxoquinazolin-3-yl)propanamide

C21H23N3O3 — CID 55902104

IUPACN-(4-methyl-2-propoxyphenyl)-3-(4-oxoquinazolin-3-yl)propanamide
SMILESCCCOc1cc(C)ccc1NC(=O)CCn1cnc2ccccc2c1=O
InChIInChI=1S/C21H23N3O3/c1-3-12-27-19-13-15(2)8-9-18(19)23-20(25)10-11-24-14-22-17-7-5-4-6-16(17)21(24)26/h4-9,13-14H,3,10-12H2,1-2H3,(H,23,25)
InChIKeyRQEYFEKEFOPNKO-UHFFFAOYSA-N
MW365.43 g/mol
LogP3.52
Rot. Bonds7

About N-(4-methyl-2-propoxyphenyl)-3-(4-oxoquinazolin-3-yl)propanamide

N-(4-methyl-2-propoxyphenyl)-3-(4-oxoquinazolin-3-yl)propanamide (PubChem CID 55902104) has the molecular formula C21H23N3O3 and a molecular weight of 365.43 g/mol. Its IUPAC name is N-(4-methyl-2-propoxyphenyl)-3-(4-oxoquinazolin-3-yl)propanamide.

Molecular Properties

Compound NameN-(4-methyl-2-propoxyphenyl)-3-(4-oxoquinazolin-3-yl)propanamide
PubChem CID55902104
Molecular FormulaC21H23N3O3
Molecular Weight365.43 g/mol
Exact Mass365.17
IUPAC NameN-(4-methyl-2-propoxyphenyl)-3-(4-oxoquinazolin-3-yl)propanamide
SMILESCCCOc1cc(C)ccc1NC(=O)CCn1cnc2ccccc2c1=O
InChIInChI=1S/C21H23N3O3/c1-3-12-27-19-13-15(2)8-9-18(19)23-20(25)10-11-24-14-22-17-7-5-4-6-16(17)21(24)26/h4-9,13-14H,3,10-12H2,1-2H3,(H,23,25)
InChIKeyRQEYFEKEFOPNKO-UHFFFAOYSA-N
XLogP3.52
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.43
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(4-methyl-2-propoxyphenyl)-3-(4-oxoquinazolin-3-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-(2-acetamido-5-methylphenyl)-3-(4-oxoquinazolin-3-yl)propanamide
CID 131906477
N-[2-(4-methylphenoxy)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide
CID 27147986
N-(4-methyl-2-propoxyphenyl)butanamide
CID 61061572
N-[2-(difluoromethoxy)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide
CID 27147340
N-[2-(2-chlorophenoxy)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide
CID 16573190
3-(4-oxoquinazolin-3-yl)-N-(3,4,5-trimethoxyphenyl)propanamide
CID 26835382
N-(6-ethoxypyrimidin-4-yl)-3-(4-oxoquinazolin-3-yl)propanamide
CID 71795774
N-(3-chloro-4-methoxyphenyl)-3-(4-oxoquinazolin-3-yl)propanamide
CID 4903088
3-[2-(2,4-dimethylphenoxy)ethyl]quinazolin-4-one
CID 973535
N-(3,5-dimethoxyphenyl)-3-(4-oxoquinazolin-3-yl)propanamide
CID 4905328
N-(2-chloro-4-methylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide
CID 7874794
tert-butyl N-[2-[3-(4-oxoquinazolin-3-yl)propanoylamino]-4-(trifluoromethyl)phenyl]carbamate
CID 55969603

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2-propoxyphenyl)-3-(4-oxoquinazolin-3-yl)propanamide?
The IUPAC name of N-(4-methyl-2-propoxyphenyl)-3-(4-oxoquinazolin-3-yl)propanamide (CID 55902104) is N-(4-methyl-2-propoxyphenyl)-3-(4-oxoquinazolin-3-yl)propanamide.
What is the SMILES notation for N-(4-methyl-2-propoxyphenyl)-3-(4-oxoquinazolin-3-yl)propanamide?
The canonical SMILES for N-(4-methyl-2-propoxyphenyl)-3-(4-oxoquinazolin-3-yl)propanamide is CCCOc1cc(C)ccc1NC(=O)CCn1cnc2ccccc2c1=O.
What is the InChIKey of N-(4-methyl-2-propoxyphenyl)-3-(4-oxoquinazolin-3-yl)propanamide?
The InChIKey is RQEYFEKEFOPNKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O3/c1-3-12-27-19-13-15(2)8-9-18(19)23-20(25)10-11-24-14-22-17-7-5-4-6-16(17)21(24)26/h4-9,13-14H,3,10-12H2,1-2H3,(H,23,25).
What are the key properties of N-(4-methyl-2-propoxyphenyl)-3-(4-oxoquinazolin-3-yl)propanamide?
N-(4-methyl-2-propoxyphenyl)-3-(4-oxoquinazolin-3-yl)propanamide has a molecular weight of 365.43 g/mol, XLogP of 3.52, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2-propoxyphenyl)-3-(4-oxoquinazolin-3-yl)propanamide is sourced from PubChem (CID 55902104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).