N-benzyl-N-ethyl-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide

C21H23N3O2 — CID 27147978

IUPACN-benzyl-N-ethyl-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide
SMILESCCN(Cc1ccccc1)C(=O)CCn1cnc2c(C)cccc2c1=O
InChIInChI=1S/C21H23N3O2/c1-3-23(14-17-9-5-4-6-10-17)19(25)12-13-24-15-22-20-16(2)8-7-11-18(20)21(24)26/h4-11,15H,3,12-14H2,1-2H3
InChIKeyQYYGGKINQCPCIF-UHFFFAOYSA-N
MW349.43 g/mol
LogP3.14
Rot. Bonds6

About N-benzyl-N-ethyl-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide

N-benzyl-N-ethyl-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide (PubChem CID 27147978) has the molecular formula C21H23N3O2 and a molecular weight of 349.43 g/mol. Its IUPAC name is N-benzyl-N-ethyl-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide.

Molecular Properties

Compound NameN-benzyl-N-ethyl-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide
PubChem CID27147978
Molecular FormulaC21H23N3O2
Molecular Weight349.43 g/mol
Exact Mass349.18
IUPAC NameN-benzyl-N-ethyl-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide
SMILESCCN(Cc1ccccc1)C(=O)CCn1cnc2c(C)cccc2c1=O
InChIInChI=1S/C21H23N3O2/c1-3-23(14-17-9-5-4-6-10-17)19(25)12-13-24-15-22-20-16(2)8-7-11-18(20)21(24)26/h4-11,15H,3,12-14H2,1-2H3
InChIKeyQYYGGKINQCPCIF-UHFFFAOYSA-N
XLogP3.14
TPSA55.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.43
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-benzyl-N-ethyl-3-(8-methyl-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-(3-amino-3-oxopropyl)-N-benzyl-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide
CID 134016250
N-benzyl-N-methyl-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide
CID 26004666
2-[3-(8-methyl-4-oxoquinazolin-3-yl)propanoyl-propylamino]acetic acid
CID 119204774
N-ethyl-3-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)propanamide
CID 46550537
N-methyl-3-(8-methyl-4-oxoquinazolin-3-yl)-N-[(2-methylphenyl)methyl]propanamide
CID 43035945
N-[(4-fluorophenyl)methyl]-N-methyl-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide
CID 46474620
4-[methyl-[3-(8-methyl-4-oxoquinazolin-3-yl)propanoyl]amino]butanoic acid
CID 119137222
N-benzyl-N-(furan-2-ylmethyl)-2-(8-methyl-4-oxoquinazolin-3-yl)acetamide
CID 37428295
4-(8-methyl-4-oxoquinazolin-3-yl)-N-[(5-methylthiophen-2-yl)methyl]-N-(2-phenylethyl)butanamide
CID 24555681
N-ethyl-N-(4-fluorophenyl)-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide
CID 24535110
N,N-diethyl-4-[3-(8-methyl-4-oxoquinazolin-3-yl)propanoylamino]benzamide
CID 39723808
N'-[3-(8-methyl-4-oxoquinazolin-3-yl)propanoyl]benzohydrazide
CID 25326839

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-ethyl-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide?
The IUPAC name of N-benzyl-N-ethyl-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide (CID 27147978) is N-benzyl-N-ethyl-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide.
What is the SMILES notation for N-benzyl-N-ethyl-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide?
The canonical SMILES for N-benzyl-N-ethyl-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide is CCN(Cc1ccccc1)C(=O)CCn1cnc2c(C)cccc2c1=O.
What is the InChIKey of N-benzyl-N-ethyl-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide?
The InChIKey is QYYGGKINQCPCIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O2/c1-3-23(14-17-9-5-4-6-10-17)19(25)12-13-24-15-22-20-16(2)8-7-11-18(20)21(24)26/h4-11,15H,3,12-14H2,1-2H3.
What are the key properties of N-benzyl-N-ethyl-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide?
N-benzyl-N-ethyl-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide has a molecular weight of 349.43 g/mol, XLogP of 3.14, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-ethyl-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide is sourced from PubChem (CID 27147978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).