N-benzyl-2-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]acetamide

C20H20N4O3 — CID 39822353

IUPACN-benzyl-2-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]acetamide
SMILESCc1nc2ccccc2c(=O)n1CC(=O)NCC(=O)NCc1ccccc1
InChIInChI=1S/C20H20N4O3/c1-14-23-17-10-6-5-9-16(17)20(27)24(14)13-19(26)22-12-18(25)21-11-15-7-3-2-4-8-15/h2-10H,11-13H2,1H3,(H,21,25)(H,22,26)
InChIKeyBMHZUMXAVIQQCS-UHFFFAOYSA-N
MW364.41 g/mol
LogP1.14
Rot. Bonds6

About N-benzyl-2-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]acetamide

N-benzyl-2-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]acetamide (PubChem CID 39822353) has the molecular formula C20H20N4O3 and a molecular weight of 364.41 g/mol. Its IUPAC name is N-benzyl-2-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]acetamide.

Molecular Properties

Compound NameN-benzyl-2-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]acetamide
PubChem CID39822353
Molecular FormulaC20H20N4O3
Molecular Weight364.41 g/mol
Exact Mass364.15
IUPAC NameN-benzyl-2-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]acetamide
SMILESCc1nc2ccccc2c(=O)n1CC(=O)NCC(=O)NCc1ccccc1
InChIInChI=1S/C20H20N4O3/c1-14-23-17-10-6-5-9-16(17)20(27)24(14)13-19(26)22-12-18(25)21-11-15-7-3-2-4-8-15/h2-10H,11-13H2,1H3,(H,21,25)(H,22,26)
InChIKeyBMHZUMXAVIQQCS-UHFFFAOYSA-N
XLogP1.14
TPSA93.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.41
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-benzyl-2-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]acetamide 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-benzyl-2-(2,6-dimethyl-4-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl)acetamide
CID 110429851
2-(2-methyl-4-oxoquinazolin-3-yl)acetate
CID 6971388
2-[4-[(2-methyl-4-oxoquinazolin-3-yl)methyl]piperidin-1-yl]-N-[(4-methylphenyl)methyl]acetamide
CID 163345449
N-(2-methoxyphenyl)-2-(2-methyl-4-oxoquinazolin-3-yl)acetamide
CID 860126
2-(6-fluoro-2-methyl-4-oxoquinazolin-3-yl)-N-(pyridin-4-ylmethyl)acetamide
CID 71700514
N-[2-(2-bicyclo[2.2.1]heptanyl)ethyl]-2-(2-methyl-4-oxoquinazolin-3-yl)acetamide
CID 71893269
1-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]-3-(4-methylphenyl)thiourea
CID 3038441
N-(3-amino-3-oxopropyl)-2-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]benzamide
CID 56573307
N-benzyl-2-[2-(benzylamino)-5-bromo-4-methyl-6-oxopyrimidin-1-yl]acetamide
CID 70676682
methyl 2-[(2-methyl-4-oxoquinazolin-3-yl)methylsulfanyl]acetate
CID 21004517
N-[(4-ethylphenyl)-thiophen-2-ylmethyl]-2-(2-methyl-4-oxoquinazolin-3-yl)acetamide
CID 55575513
N-benzyl-2-(2-propan-2-ylbenzimidazol-1-yl)acetamide
CID 17028642

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]acetamide?
The IUPAC name of N-benzyl-2-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]acetamide (CID 39822353) is N-benzyl-2-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]acetamide.
What is the SMILES notation for N-benzyl-2-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]acetamide?
The canonical SMILES for N-benzyl-2-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]acetamide is Cc1nc2ccccc2c(=O)n1CC(=O)NCC(=O)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]acetamide?
The InChIKey is BMHZUMXAVIQQCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O3/c1-14-23-17-10-6-5-9-16(17)20(27)24(14)13-19(26)22-12-18(25)21-11-15-7-3-2-4-8-15/h2-10H,11-13H2,1H3,(H,21,25)(H,22,26).
What are the key properties of N-benzyl-2-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]acetamide?
N-benzyl-2-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]acetamide has a molecular weight of 364.41 g/mol, XLogP of 1.14, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]acetamide is sourced from PubChem (CID 39822353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).