2-(2-benzyl-4-oxoquinazolin-3-yl)-N-cyclohexylacetamide

C23H25N3O2 — CID 1462734

IUPAC2-(2-benzyl-4-oxoquinazolin-3-yl)-N-cyclohexylacetamide
SMILESO=C(Cn1c(Cc2ccccc2)nc2ccccc2c1=O)NC1CCCCC1
InChIInChI=1S/C23H25N3O2/c27-22(24-18-11-5-2-6-12-18)16-26-21(15-17-9-3-1-4-10-17)25-20-14-8-7-13-19(20)23(26)28/h1,3-4,7-10,13-14,18H,2,5-6,11-12,15-16H2,(H,24,27)
InChIKeyCKZDRVDSIRCUCC-UHFFFAOYSA-N
MW375.47 g/mol
LogP3.44
Rot. Bonds5

About 2-(2-benzyl-4-oxoquinazolin-3-yl)-N-cyclohexylacetamide

2-(2-benzyl-4-oxoquinazolin-3-yl)-N-cyclohexylacetamide (PubChem CID 1462734) has the molecular formula C23H25N3O2 and a molecular weight of 375.47 g/mol. Its IUPAC name is 2-(2-benzyl-4-oxoquinazolin-3-yl)-N-cyclohexylacetamide.

Molecular Properties

Compound Name2-(2-benzyl-4-oxoquinazolin-3-yl)-N-cyclohexylacetamide
PubChem CID1462734
Molecular FormulaC23H25N3O2
Molecular Weight375.47 g/mol
Exact Mass375.19
IUPAC Name2-(2-benzyl-4-oxoquinazolin-3-yl)-N-cyclohexylacetamide
SMILESO=C(Cn1c(Cc2ccccc2)nc2ccccc2c1=O)NC1CCCCC1
InChIInChI=1S/C23H25N3O2/c27-22(24-18-11-5-2-6-12-18)16-26-21(15-17-9-3-1-4-10-17)25-20-14-8-7-13-19(20)23(26)28/h1,3-4,7-10,13-14,18H,2,5-6,11-12,15-16H2,(H,24,27)
InChIKeyCKZDRVDSIRCUCC-UHFFFAOYSA-N
XLogP3.44
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.47
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclohexyl-2-[4-oxo-2-(piperidin-1-ylmethyl)quinazolin-3-yl]acetamide
CID 655418
N-cycloheptyl-2-(4-oxoquinazolin-3-yl)acetamide
CID 4815745
N-[(1S,2R)-2-methylcyclohexyl]-2-[4-oxo-2-(piperidin-1-ylmethyl)quinazolin-3-yl]acetamide
CID 1166555
2-[3-[(4-chlorophenyl)methyl]-4-oxoquinazolin-2-yl]sulfanyl-N-cyclohexylacetamide
CID 2440467
N-cycloheptyl-2-[3-(3-hydroxypropyl)-4-oxoquinazolin-2-yl]sulfanylacetamide
CID 4822867
N-cyclohexyl-2-(2-propylbenzimidazol-1-yl)acetamide
CID 17028657
[3-(2-amino-2-oxoethyl)-4-oxoquinazolin-2-yl]methyl-cyclooctylazanium
CID 8558706
N,N-dicyclohexyl-2-(2-ethyl-4-oxoquinazolin-3-yl)acetamide
CID 23967281
N-cyclohexyl-2-[3-(2-methylpropyl)-2,4-dioxoquinazolin-1-yl]acetamide
CID 45030701
N-cyclooctyl-2-(3-ethyl-2,4-dioxoquinazolin-1-yl)acetamide
CID 22110617
N-cyclohexyl-2-(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanylacetamide
CID 8979979
N-cyclooctyl-2-[2-(methylsulfonylmethyl)benzimidazol-1-yl]acetamide
CID 34366434

Frequently Asked Questions

What is the IUPAC name of 2-(2-benzyl-4-oxoquinazolin-3-yl)-N-cyclohexylacetamide?
The IUPAC name of 2-(2-benzyl-4-oxoquinazolin-3-yl)-N-cyclohexylacetamide (CID 1462734) is 2-(2-benzyl-4-oxoquinazolin-3-yl)-N-cyclohexylacetamide.
What is the SMILES notation for 2-(2-benzyl-4-oxoquinazolin-3-yl)-N-cyclohexylacetamide?
The canonical SMILES for 2-(2-benzyl-4-oxoquinazolin-3-yl)-N-cyclohexylacetamide is O=C(Cn1c(Cc2ccccc2)nc2ccccc2c1=O)NC1CCCCC1.
What is the InChIKey of 2-(2-benzyl-4-oxoquinazolin-3-yl)-N-cyclohexylacetamide?
The InChIKey is CKZDRVDSIRCUCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O2/c27-22(24-18-11-5-2-6-12-18)16-26-21(15-17-9-3-1-4-10-17)25-20-14-8-7-13-19(20)23(26)28/h1,3-4,7-10,13-14,18H,2,5-6,11-12,15-16H2,(H,24,27).
What are the key properties of 2-(2-benzyl-4-oxoquinazolin-3-yl)-N-cyclohexylacetamide?
2-(2-benzyl-4-oxoquinazolin-3-yl)-N-cyclohexylacetamide has a molecular weight of 375.47 g/mol, XLogP of 3.44, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-benzyl-4-oxoquinazolin-3-yl)-N-cyclohexylacetamide is sourced from PubChem (CID 1462734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).