N-[3-(4-methoxyphenyl)-2-methyl-4-oxoquinazolin-6-yl]propanamide

C19H19N3O3 — CID 30368236

IUPACN-[3-(4-methoxyphenyl)-2-methyl-4-oxoquinazolin-6-yl]propanamide
SMILESCCC(=O)Nc1ccc2nc(C)n(-c3ccc(OC)cc3)c(=O)c2c1
InChIInChI=1S/C19H19N3O3/c1-4-18(23)21-13-5-10-17-16(11-13)19(24)22(12(2)20-17)14-6-8-15(25-3)9-7-14/h5-11H,4H2,1-3H3,(H,21,23)
InChIKeyPIKYCEYKUZEVAW-UHFFFAOYSA-N
MW337.38 g/mol
LogP3.05
Rot. Bonds4

About N-[3-(4-methoxyphenyl)-2-methyl-4-oxoquinazolin-6-yl]propanamide

N-[3-(4-methoxyphenyl)-2-methyl-4-oxoquinazolin-6-yl]propanamide (PubChem CID 30368236) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is N-[3-(4-methoxyphenyl)-2-methyl-4-oxoquinazolin-6-yl]propanamide.

Molecular Properties

Compound NameN-[3-(4-methoxyphenyl)-2-methyl-4-oxoquinazolin-6-yl]propanamide
PubChem CID30368236
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC NameN-[3-(4-methoxyphenyl)-2-methyl-4-oxoquinazolin-6-yl]propanamide
SMILESCCC(=O)Nc1ccc2nc(C)n(-c3ccc(OC)cc3)c(=O)c2c1
InChIInChI=1S/C19H19N3O3/c1-4-18(23)21-13-5-10-17-16(11-13)19(24)22(12(2)20-17)14-6-8-15(25-3)9-7-14/h5-11H,4H2,1-3H3,(H,21,23)
InChIKeyPIKYCEYKUZEVAW-UHFFFAOYSA-N
XLogP3.05
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(2-methyl-4-oxoquinazolin-3-yl)phenyl]propanamide
CID 7294898
1-(2,4-dimethylphenyl)-3-[3-(4-methoxyphenyl)-2-methyl-4-oxoquinazolin-6-yl]urea
CID 30368597
N-[3-(4-methoxyphenyl)-2-methyl-4-oxoquinazolin-6-yl]quinoline-2-carboxamide
CID 30867464
3-(4-methoxyphenyl)-N-[4-(2-methyl-4-oxoquinazolin-3-yl)phenyl]propanamide
CID 7577823
3-(4-methoxyphenyl)-2-methylbenzo[g]quinazolin-4-one
CID 44725647
N-[4-[(4-methoxyphenyl)methylamino]-2-methylquinazolin-6-yl]propanamide
CID 123471618
2,3-dichloro-N-[3-(4-methoxyphenyl)-2-methyl-4-oxoquinazolin-6-yl]benzenesulfonamide
CID 30867596
N-[4-(6,7-difluoro-2-methyl-4-oxoquinazolin-3-yl)phenyl]-2-phenylacetamide
CID 171649584
N-[2-methyl-3-(4-methylphenyl)-4-oxoquinazolin-6-yl]pyridine-3-carboxamide
CID 30867406
N-[4-(2-methyl-4-oxoquinazolin-3-yl)phenyl]-2-(3-methylphenyl)acetamide
CID 7294959
2-methyl-N-[2-methyl-3-(4-methylphenyl)-4-oxoquinazolin-6-yl]-3-nitrobenzamide
CID 30867420
N-[3-[[4-(4-methoxyphenyl)phenyl]methyl]-2-methyl-4-oxoquinazolin-6-yl]-2,2-dimethylpropanamide
CID 1434216

Frequently Asked Questions

What is the IUPAC name of N-[3-(4-methoxyphenyl)-2-methyl-4-oxoquinazolin-6-yl]propanamide?
The IUPAC name of N-[3-(4-methoxyphenyl)-2-methyl-4-oxoquinazolin-6-yl]propanamide (CID 30368236) is N-[3-(4-methoxyphenyl)-2-methyl-4-oxoquinazolin-6-yl]propanamide.
What is the SMILES notation for N-[3-(4-methoxyphenyl)-2-methyl-4-oxoquinazolin-6-yl]propanamide?
The canonical SMILES for N-[3-(4-methoxyphenyl)-2-methyl-4-oxoquinazolin-6-yl]propanamide is CCC(=O)Nc1ccc2nc(C)n(-c3ccc(OC)cc3)c(=O)c2c1.
What is the InChIKey of N-[3-(4-methoxyphenyl)-2-methyl-4-oxoquinazolin-6-yl]propanamide?
The InChIKey is PIKYCEYKUZEVAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-4-18(23)21-13-5-10-17-16(11-13)19(24)22(12(2)20-17)14-6-8-15(25-3)9-7-14/h5-11H,4H2,1-3H3,(H,21,23).
What are the key properties of N-[3-(4-methoxyphenyl)-2-methyl-4-oxoquinazolin-6-yl]propanamide?
N-[3-(4-methoxyphenyl)-2-methyl-4-oxoquinazolin-6-yl]propanamide has a molecular weight of 337.38 g/mol, XLogP of 3.05, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-methoxyphenyl)-2-methyl-4-oxoquinazolin-6-yl]propanamide is sourced from PubChem (CID 30368236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).