N-cyclohexyl-2-(4-oxo-5,6,7,8-tetrahydroquinazolin-3-yl)acetamide

C16H23N3O2 — CID 53014419

IUPACN-cyclohexyl-2-(4-oxo-5,6,7,8-tetrahydroquinazolin-3-yl)acetamide
SMILESO=C(Cn1cnc2c(c1=O)CCCC2)NC1CCCCC1
InChIInChI=1S/C16H23N3O2/c20-15(18-12-6-2-1-3-7-12)10-19-11-17-14-9-5-4-8-13(14)16(19)21/h11-12H,1-10H2,(H,18,20)
InChIKeyMAILFXZMCRJMLF-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.57
Rot. Bonds3

About N-cyclohexyl-2-(4-oxo-5,6,7,8-tetrahydroquinazolin-3-yl)acetamide

N-cyclohexyl-2-(4-oxo-5,6,7,8-tetrahydroquinazolin-3-yl)acetamide (PubChem CID 53014419) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is N-cyclohexyl-2-(4-oxo-5,6,7,8-tetrahydroquinazolin-3-yl)acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(4-oxo-5,6,7,8-tetrahydroquinazolin-3-yl)acetamide
PubChem CID53014419
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC NameN-cyclohexyl-2-(4-oxo-5,6,7,8-tetrahydroquinazolin-3-yl)acetamide
SMILESO=C(Cn1cnc2c(c1=O)CCCC2)NC1CCCCC1
InChIInChI=1S/C16H23N3O2/c20-15(18-12-6-2-1-3-7-12)10-19-11-17-14-9-5-4-8-13(14)16(19)21/h11-12H,1-10H2,(H,18,20)
InChIKeyMAILFXZMCRJMLF-UHFFFAOYSA-N
XLogP1.57
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-cyclohexyl-2-(4-oxo-5,6,7,8-tetrahydroquinazolin-3-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(4-oxo-5,6,7,8-tetrahydroquinazolin-3-yl)acetamide?
The IUPAC name of N-cyclohexyl-2-(4-oxo-5,6,7,8-tetrahydroquinazolin-3-yl)acetamide (CID 53014419) is N-cyclohexyl-2-(4-oxo-5,6,7,8-tetrahydroquinazolin-3-yl)acetamide.
What is the SMILES notation for N-cyclohexyl-2-(4-oxo-5,6,7,8-tetrahydroquinazolin-3-yl)acetamide?
The canonical SMILES for N-cyclohexyl-2-(4-oxo-5,6,7,8-tetrahydroquinazolin-3-yl)acetamide is O=C(Cn1cnc2c(c1=O)CCCC2)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-(4-oxo-5,6,7,8-tetrahydroquinazolin-3-yl)acetamide?
The InChIKey is MAILFXZMCRJMLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c20-15(18-12-6-2-1-3-7-12)10-19-11-17-14-9-5-4-8-13(14)16(19)21/h11-12H,1-10H2,(H,18,20).
What are the key properties of N-cyclohexyl-2-(4-oxo-5,6,7,8-tetrahydroquinazolin-3-yl)acetamide?
N-cyclohexyl-2-(4-oxo-5,6,7,8-tetrahydroquinazolin-3-yl)acetamide has a molecular weight of 289.38 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(4-oxo-5,6,7,8-tetrahydroquinazolin-3-yl)acetamide is sourced from PubChem (CID 53014419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).