N-benzhydryl-2-methoxyacetamide

C16H17NO2 — CID 798780

IUPACN-benzhydryl-2-methoxyacetamide
SMILESCOCC(=O)NC(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H17NO2/c1-19-12-15(18)17-16(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11,16H,12H2,1H3,(H,17,18)
InChIKeyFQJKVWGRKBADFP-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.54
Rot. Bonds5

About N-benzhydryl-2-methoxyacetamide

N-benzhydryl-2-methoxyacetamide (PubChem CID 798780) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is N-benzhydryl-2-methoxyacetamide.

Molecular Properties

Compound NameN-benzhydryl-2-methoxyacetamide
PubChem CID798780
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC NameN-benzhydryl-2-methoxyacetamide
SMILESCOCC(=O)NC(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H17NO2/c1-19-12-15(18)17-16(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11,16H,12H2,1H3,(H,17,18)
InChIKeyFQJKVWGRKBADFP-UHFFFAOYSA-N
XLogP2.54
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-benzhydryl-2-methoxyacetamide?
The IUPAC name of N-benzhydryl-2-methoxyacetamide (CID 798780) is N-benzhydryl-2-methoxyacetamide.
What is the SMILES notation for N-benzhydryl-2-methoxyacetamide?
The canonical SMILES for N-benzhydryl-2-methoxyacetamide is COCC(=O)NC(c1ccccc1)c1ccccc1.
What is the InChIKey of N-benzhydryl-2-methoxyacetamide?
The InChIKey is FQJKVWGRKBADFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c1-19-12-15(18)17-16(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11,16H,12H2,1H3,(H,17,18).
What are the key properties of N-benzhydryl-2-methoxyacetamide?
N-benzhydryl-2-methoxyacetamide has a molecular weight of 255.32 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzhydryl-2-methoxyacetamide is sourced from PubChem (CID 798780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).