N-(2-cyclopropyl-4-oxoquinazolin-3-yl)-3,4-dimethoxybenzamide

C20H19N3O4 — CID 3226460

IUPACN-(2-cyclopropyl-4-oxoquinazolin-3-yl)-3,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nn2c(C3CC3)nc3ccccc3c2=O)cc1OC
InChIInChI=1S/C20H19N3O4/c1-26-16-10-9-13(11-17(16)27-2)19(24)22-23-18(12-7-8-12)21-15-6-4-3-5-14(15)20(23)25/h3-6,9-12H,7-8H2,1-2H3,(H,22,24)
InChIKeyFXQKNXJBQTVIDW-UHFFFAOYSA-N
MW365.39 g/mol
LogP2.67
Rot. Bonds5

About N-(2-cyclopropyl-4-oxoquinazolin-3-yl)-3,4-dimethoxybenzamide

N-(2-cyclopropyl-4-oxoquinazolin-3-yl)-3,4-dimethoxybenzamide (PubChem CID 3226460) has the molecular formula C20H19N3O4 and a molecular weight of 365.39 g/mol. Its IUPAC name is N-(2-cyclopropyl-4-oxoquinazolin-3-yl)-3,4-dimethoxybenzamide.

Molecular Properties

Compound NameN-(2-cyclopropyl-4-oxoquinazolin-3-yl)-3,4-dimethoxybenzamide
PubChem CID3226460
Molecular FormulaC20H19N3O4
Molecular Weight365.39 g/mol
Exact Mass365.14
IUPAC NameN-(2-cyclopropyl-4-oxoquinazolin-3-yl)-3,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nn2c(C3CC3)nc3ccccc3c2=O)cc1OC
InChIInChI=1S/C20H19N3O4/c1-26-16-10-9-13(11-17(16)27-2)19(24)22-23-18(12-7-8-12)21-15-6-4-3-5-14(15)20(23)25/h3-6,9-12H,7-8H2,1-2H3,(H,22,24)
InChIKeyFXQKNXJBQTVIDW-UHFFFAOYSA-N
XLogP2.67
TPSA82.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.39
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(2-cyclopropyl-4-oxoquinazolin-3-yl)-3,4-dimethoxybenzamide 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-benzyl-4-oxoquinazolin-3-yl)-3,4-dimethoxybenzamide
CID 43816379
4-tert-butyl-N-(2-cyclohexyl-4-oxoquinazolin-3-yl)benzamide
CID 23762494
N-(2-cyclopropyl-6,7-dimethoxy-4-oxoquinazolin-3-yl)-2-methylbenzamide
CID 1457899
N-(2-cyclobutyl-4-oxoquinazolin-3-yl)-2-ethoxybenzamide
CID 650215
N-(2-cyclobutyl-4-oxoquinazolin-3-yl)pyridine-3-carboxamide
CID 43816389
N-(7-chloro-2-cyclobutyl-4-oxoquinazolin-3-yl)benzamide
CID 6487223
3-chloro-N-(2-cyclobutyl-6,7-dimethoxy-4-oxoquinazolin-3-yl)-1-benzothiophene-2-carboxamide
CID 1457967
N-(2-cyclopropyl-6,7-dimethoxy-4-oxoquinazolin-3-yl)-4-methoxycyclohexane-1-carboxamide
CID 1457930
2-cycloheptyl-N-(2-cyclohexyl-4-oxoquinazolin-3-yl)acetamide
CID 70838370
N-(2-methyl-4-oxoquinazolin-3-yl)benzamide
CID 807598
1-benzyl-3-(2-cyclohexyl-4-oxoquinazolin-3-yl)urea
CID 70838562
3,4-dimethoxy-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide
CID 136524569

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropyl-4-oxoquinazolin-3-yl)-3,4-dimethoxybenzamide?
The IUPAC name of N-(2-cyclopropyl-4-oxoquinazolin-3-yl)-3,4-dimethoxybenzamide (CID 3226460) is N-(2-cyclopropyl-4-oxoquinazolin-3-yl)-3,4-dimethoxybenzamide.
What is the SMILES notation for N-(2-cyclopropyl-4-oxoquinazolin-3-yl)-3,4-dimethoxybenzamide?
The canonical SMILES for N-(2-cyclopropyl-4-oxoquinazolin-3-yl)-3,4-dimethoxybenzamide is COc1ccc(C(=O)Nn2c(C3CC3)nc3ccccc3c2=O)cc1OC.
What is the InChIKey of N-(2-cyclopropyl-4-oxoquinazolin-3-yl)-3,4-dimethoxybenzamide?
The InChIKey is FXQKNXJBQTVIDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O4/c1-26-16-10-9-13(11-17(16)27-2)19(24)22-23-18(12-7-8-12)21-15-6-4-3-5-14(15)20(23)25/h3-6,9-12H,7-8H2,1-2H3,(H,22,24).
What are the key properties of N-(2-cyclopropyl-4-oxoquinazolin-3-yl)-3,4-dimethoxybenzamide?
N-(2-cyclopropyl-4-oxoquinazolin-3-yl)-3,4-dimethoxybenzamide has a molecular weight of 365.39 g/mol, XLogP of 2.67, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropyl-4-oxoquinazolin-3-yl)-3,4-dimethoxybenzamide is sourced from PubChem (CID 3226460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).