2-(methoxymethyl)-N-(4-oxo-3,1-benzoxazin-2-yl)benzamide

C17H14N2O4 — CID 57069931

IUPAC2-(methoxymethyl)-N-(4-oxo-3,1-benzoxazin-2-yl)benzamide
SMILESCOCc1ccccc1C(=O)Nc1nc2ccccc2c(=O)o1
InChIInChI=1S/C17H14N2O4/c1-22-10-11-6-2-3-7-12(11)15(20)19-17-18-14-9-5-4-8-13(14)16(21)23-17/h2-9H,10H2,1H3,(H,18,19,20)
InChIKeyURTOBMHDZFTFRC-UHFFFAOYSA-N
MW310.31 g/mol
LogP2.59
Rot. Bonds4

About 2-(methoxymethyl)-N-(4-oxo-3,1-benzoxazin-2-yl)benzamide

2-(methoxymethyl)-N-(4-oxo-3,1-benzoxazin-2-yl)benzamide (PubChem CID 57069931) has the molecular formula C17H14N2O4 and a molecular weight of 310.31 g/mol. Its IUPAC name is 2-(methoxymethyl)-N-(4-oxo-3,1-benzoxazin-2-yl)benzamide.

Molecular Properties

Compound Name2-(methoxymethyl)-N-(4-oxo-3,1-benzoxazin-2-yl)benzamide
PubChem CID57069931
Molecular FormulaC17H14N2O4
Molecular Weight310.31 g/mol
Exact Mass310.10
IUPAC Name2-(methoxymethyl)-N-(4-oxo-3,1-benzoxazin-2-yl)benzamide
SMILESCOCc1ccccc1C(=O)Nc1nc2ccccc2c(=O)o1
InChIInChI=1S/C17H14N2O4/c1-22-10-11-6-2-3-7-12(11)15(20)19-17-18-14-9-5-4-8-13(14)16(21)23-17/h2-9H,10H2,1H3,(H,18,19,20)
InChIKeyURTOBMHDZFTFRC-UHFFFAOYSA-N
XLogP2.59
TPSA81.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.31
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(methoxymethyl)-N-(4-oxo-3,1-benzoxazin-2-yl)benzamide 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 2-(methoxymethyl)-N-(4-oxo-3,1-benzoxazin-2-yl)benzamide?
The IUPAC name of 2-(methoxymethyl)-N-(4-oxo-3,1-benzoxazin-2-yl)benzamide (CID 57069931) is 2-(methoxymethyl)-N-(4-oxo-3,1-benzoxazin-2-yl)benzamide.
What is the SMILES notation for 2-(methoxymethyl)-N-(4-oxo-3,1-benzoxazin-2-yl)benzamide?
The canonical SMILES for 2-(methoxymethyl)-N-(4-oxo-3,1-benzoxazin-2-yl)benzamide is COCc1ccccc1C(=O)Nc1nc2ccccc2c(=O)o1.
What is the InChIKey of 2-(methoxymethyl)-N-(4-oxo-3,1-benzoxazin-2-yl)benzamide?
The InChIKey is URTOBMHDZFTFRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O4/c1-22-10-11-6-2-3-7-12(11)15(20)19-17-18-14-9-5-4-8-13(14)16(21)23-17/h2-9H,10H2,1H3,(H,18,19,20).
What are the key properties of 2-(methoxymethyl)-N-(4-oxo-3,1-benzoxazin-2-yl)benzamide?
2-(methoxymethyl)-N-(4-oxo-3,1-benzoxazin-2-yl)benzamide has a molecular weight of 310.31 g/mol, XLogP of 2.59, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-N-(4-oxo-3,1-benzoxazin-2-yl)benzamide is sourced from PubChem (CID 57069931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).