2-benzhydryloxy-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)acetamide

C24H22N2O4 — CID 46616642

IUPAC2-benzhydryloxy-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)acetamide
SMILESCC1Oc2ccc(NC(=O)COC(c3ccccc3)c3ccccc3)cc2NC1=O
InChIInChI=1S/C24H22N2O4/c1-16-24(28)26-20-14-19(12-13-21(20)30-16)25-22(27)15-29-23(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-14,16,23H,15H2,1H3,(H,25,27)(H,26,28)
InChIKeyWYJDJWBNKKAZCE-UHFFFAOYSA-N
MW402.45 g/mol
LogP4.15
Rot. Bonds6

About 2-benzhydryloxy-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)acetamide

2-benzhydryloxy-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)acetamide (PubChem CID 46616642) has the molecular formula C24H22N2O4 and a molecular weight of 402.45 g/mol. Its IUPAC name is 2-benzhydryloxy-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)acetamide.

Molecular Properties

Compound Name2-benzhydryloxy-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)acetamide
PubChem CID46616642
Molecular FormulaC24H22N2O4
Molecular Weight402.45 g/mol
Exact Mass402.16
IUPAC Name2-benzhydryloxy-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)acetamide
SMILESCC1Oc2ccc(NC(=O)COC(c3ccccc3)c3ccccc3)cc2NC1=O
InChIInChI=1S/C24H22N2O4/c1-16-24(28)26-20-14-19(12-13-21(20)30-16)25-22(27)15-29-23(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-14,16,23H,15H2,1H3,(H,25,27)(H,26,28)
InChIKeyWYJDJWBNKKAZCE-UHFFFAOYSA-N
XLogP4.15
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.45
LogP ≤ 54.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-benzhydryloxy-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-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

2-(2-methoxyphenoxy)-N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]acetamide
CID 9145221
N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-2-(2-propan-2-ylphenoxy)acetamide
CID 9145489
N-[(2R)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]propanamide
CID 42506170
2-(2-chlorophenoxy)-N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]acetamide
CID 9145207
(2R)-N-[(2R)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-2-phenoxy-2-phenylacetamide
CID 51955827
1-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-3-phenylurea
CID 41291616
(2S)-N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-2-phenylpentanamide
CID 9145292
(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)carbamic acid
CID 115170648
N-[2-[[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]amino]-2-oxoethyl]-2-phenylacetamide
CID 9145419
2-(2-fluorophenyl)-N-[(2R)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]acetamide
CID 9145610
N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-2-(propan-2-ylamino)acetamide
CID 60843067
N-[4-[(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)amino]-4-oxobutan-2-yl]benzamide
CID 46628672

Frequently Asked Questions

What is the IUPAC name of 2-benzhydryloxy-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)acetamide?
The IUPAC name of 2-benzhydryloxy-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)acetamide (CID 46616642) is 2-benzhydryloxy-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)acetamide.
What is the SMILES notation for 2-benzhydryloxy-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)acetamide?
The canonical SMILES for 2-benzhydryloxy-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)acetamide is CC1Oc2ccc(NC(=O)COC(c3ccccc3)c3ccccc3)cc2NC1=O.
What is the InChIKey of 2-benzhydryloxy-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)acetamide?
The InChIKey is WYJDJWBNKKAZCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O4/c1-16-24(28)26-20-14-19(12-13-21(20)30-16)25-22(27)15-29-23(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-14,16,23H,15H2,1H3,(H,25,27)(H,26,28).
What are the key properties of 2-benzhydryloxy-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)acetamide?
2-benzhydryloxy-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)acetamide has a molecular weight of 402.45 g/mol, XLogP of 4.15, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzhydryloxy-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)acetamide is sourced from PubChem (CID 46616642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).