N-(3-methoxyphenyl)-2-(4-oxoquinazolin-3-yl)propanamide

C18H17N3O3 — CID 2918932

IUPACN-(3-methoxyphenyl)-2-(4-oxoquinazolin-3-yl)propanamide
SMILESCOc1cccc(NC(=O)C(C)n2cnc3ccccc3c2=O)c1
InChIInChI=1S/C18H17N3O3/c1-12(17(22)20-13-6-5-7-14(10-13)24-2)21-11-19-16-9-4-3-8-15(16)18(21)23/h3-12H,1-2H3,(H,20,22)
InChIKeyUZQCTQDVCMIONS-UHFFFAOYSA-N
MW323.35 g/mol
LogP2.60
Rot. Bonds4

About N-(3-methoxyphenyl)-2-(4-oxoquinazolin-3-yl)propanamide

N-(3-methoxyphenyl)-2-(4-oxoquinazolin-3-yl)propanamide (PubChem CID 2918932) has the molecular formula C18H17N3O3 and a molecular weight of 323.35 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-2-(4-oxoquinazolin-3-yl)propanamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-2-(4-oxoquinazolin-3-yl)propanamide
PubChem CID2918932
Molecular FormulaC18H17N3O3
Molecular Weight323.35 g/mol
Exact Mass323.13
IUPAC NameN-(3-methoxyphenyl)-2-(4-oxoquinazolin-3-yl)propanamide
SMILESCOc1cccc(NC(=O)C(C)n2cnc3ccccc3c2=O)c1
InChIInChI=1S/C18H17N3O3/c1-12(17(22)20-13-6-5-7-14(10-13)24-2)21-11-19-16-9-4-3-8-15(16)18(21)23/h3-12H,1-2H3,(H,20,22)
InChIKeyUZQCTQDVCMIONS-UHFFFAOYSA-N
XLogP2.60
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.35
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-N-(7-methoxyquinolin-3-yl)-2-(4-oxoquinazolin-3-yl)propanamide
CID 71825572
N-(3-methylphenyl)-2-(4-oxoquinazolin-3-yl)propanamide
CID 3150564
(2S)-N-(3-bromophenyl)-2-(4-oxoquinazolin-3-yl)propanamide
CID 7581019
(2S)-N-(4-bromophenyl)-2-(4-oxoquinazolin-3-yl)propanamide
CID 1323660
(2R)-N-(3-methoxyphenyl)-2-(1-oxophthalazin-2-yl)propanamide
CID 95118182
(2S)-2-(1,3-dioxoisoindol-2-yl)-N-(3-methoxyphenyl)propanamide
CID 679819
(2S)-2-(4-oxoquinazolin-3-yl)propanoic acid
CID 771110
N-(1,3-benzothiazol-2-yl)-2-(4-oxoquinazolin-3-yl)propanamide
CID 4907134
(2S)-N-(3-methoxyphenyl)-2-[3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide
CID 9360732
(2S)-N-(3-methoxyphenyl)-2-(6-oxo-3-phenylpyridazin-1-yl)propanamide
CID 28623082
(2S)-N-(4-fluorophenyl)-3-methyl-2-(4-oxoquinazolin-3-yl)butanamide
CID 7632851
(2S)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(3-methoxyphenyl)-2-phenylacetamide
CID 40656553

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-2-(4-oxoquinazolin-3-yl)propanamide?
The IUPAC name of N-(3-methoxyphenyl)-2-(4-oxoquinazolin-3-yl)propanamide (CID 2918932) is N-(3-methoxyphenyl)-2-(4-oxoquinazolin-3-yl)propanamide.
What is the SMILES notation for N-(3-methoxyphenyl)-2-(4-oxoquinazolin-3-yl)propanamide?
The canonical SMILES for N-(3-methoxyphenyl)-2-(4-oxoquinazolin-3-yl)propanamide is COc1cccc(NC(=O)C(C)n2cnc3ccccc3c2=O)c1.
What is the InChIKey of N-(3-methoxyphenyl)-2-(4-oxoquinazolin-3-yl)propanamide?
The InChIKey is UZQCTQDVCMIONS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O3/c1-12(17(22)20-13-6-5-7-14(10-13)24-2)21-11-19-16-9-4-3-8-15(16)18(21)23/h3-12H,1-2H3,(H,20,22).
What are the key properties of N-(3-methoxyphenyl)-2-(4-oxoquinazolin-3-yl)propanamide?
N-(3-methoxyphenyl)-2-(4-oxoquinazolin-3-yl)propanamide has a molecular weight of 323.35 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-2-(4-oxoquinazolin-3-yl)propanamide is sourced from PubChem (CID 2918932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).