N-cyclopropyl-2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)acetamide

C14H16N2O3 — CID 3224963

IUPACN-cyclopropyl-2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)acetamide
SMILESCC1Oc2ccccc2N(CC(=O)NC2CC2)C1=O
InChIInChI=1S/C14H16N2O3/c1-9-14(18)16(8-13(17)15-10-6-7-10)11-4-2-3-5-12(11)19-9/h2-5,9-10H,6-8H2,1H3,(H,15,17)
InChIKeyZEOXOKLRCZFDME-UHFFFAOYSA-N
MW260.29 g/mol
LogP1.08
Rot. Bonds3

About N-cyclopropyl-2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)acetamide

N-cyclopropyl-2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)acetamide (PubChem CID 3224963) has the molecular formula C14H16N2O3 and a molecular weight of 260.29 g/mol. Its IUPAC name is N-cyclopropyl-2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)acetamide
PubChem CID3224963
Molecular FormulaC14H16N2O3
Molecular Weight260.29 g/mol
Exact Mass260.12
IUPAC NameN-cyclopropyl-2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)acetamide
SMILESCC1Oc2ccccc2N(CC(=O)NC2CC2)C1=O
InChIInChI=1S/C14H16N2O3/c1-9-14(18)16(8-13(17)15-10-6-7-10)11-4-2-3-5-12(11)19-9/h2-5,9-10H,6-8H2,1H3,(H,15,17)
InChIKeyZEOXOKLRCZFDME-UHFFFAOYSA-N
XLogP1.08
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclopropyl-2-(2-methyl-3-oxo-1,4-benzoxazin-4-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

Related Compounds

3-Methyl-3,4-dihydro-2H-1,4-benzoxazine
CID 2763760
1-(2-Ethoxyphenyl)piperazine
CID 83357
2H-1,4-benzoxazin-3(4H)-one
CID 72757
3,4-Dihydro-2H-1,4-benzoxazine-2-carboxamide
CID 26120
1-[2-(Propan-2-yloxy)phenyl]piperazine
CID 10944016
Rwj-69736
CID 9866614
Propetamide
CID 68937
Acetamide, N-(4-(3-(4-(2-methoxyphenyl)-1-piperazinyl)propoxy)phenyl)-
CID 55421
8-((6,6-dimethylhepta-2,4-diyn-1-yl)(methyl)amino)-3,4-dihydro-2H-1,4-benzoxazin-3-one
CID 102008720
Rwj-38063
CID 9887378
Rwj-68157
CID 9888164
1-(2-Butoxyphenyl)piperazine
CID 14479837

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)acetamide?
The IUPAC name of N-cyclopropyl-2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)acetamide (CID 3224963) is N-cyclopropyl-2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)acetamide.
What is the SMILES notation for N-cyclopropyl-2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)acetamide?
The canonical SMILES for N-cyclopropyl-2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)acetamide is CC1Oc2ccccc2N(CC(=O)NC2CC2)C1=O.
What is the InChIKey of N-cyclopropyl-2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)acetamide?
The InChIKey is ZEOXOKLRCZFDME-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3/c1-9-14(18)16(8-13(17)15-10-6-7-10)11-4-2-3-5-12(11)19-9/h2-5,9-10H,6-8H2,1H3,(H,15,17).
What are the key properties of N-cyclopropyl-2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)acetamide?
N-cyclopropyl-2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)acetamide has a molecular weight of 260.29 g/mol, XLogP of 1.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)acetamide is sourced from PubChem (CID 3224963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).