methylphosphane;N-(2-oxopropyl)-2-phenylacetamide

C12H18NO2P — CID 161423403

IUPACmethylphosphane;N-(2-oxopropyl)-2-phenylacetamide
SMILESCC(=O)CNC(=O)Cc1ccccc1.CP
InChIInChI=1S/C11H13NO2.CH5P/c1-9(13)8-12-11(14)7-10-5-3-2-4-6-10;1-2/h2-6H,7-8H2,1H3,(H,12,14);2H2,1H3
InChIKeyVXANQINPKUQIFP-UHFFFAOYSA-N
MW239.25 g/mol
LogP1.43
Rot. Bonds4

About methylphosphane;N-(2-oxopropyl)-2-phenylacetamide

methylphosphane;N-(2-oxopropyl)-2-phenylacetamide (PubChem CID 161423403) has the molecular formula C12H18NO2P and a molecular weight of 239.25 g/mol. Its IUPAC name is methylphosphane;N-(2-oxopropyl)-2-phenylacetamide.

Molecular Properties

Compound Namemethylphosphane;N-(2-oxopropyl)-2-phenylacetamide
PubChem CID161423403
Molecular FormulaC12H18NO2P
Molecular Weight239.25 g/mol
Exact Mass239.11
IUPAC Namemethylphosphane;N-(2-oxopropyl)-2-phenylacetamide
SMILESCC(=O)CNC(=O)Cc1ccccc1.CP
InChIInChI=1S/C11H13NO2.CH5P/c1-9(13)8-12-11(14)7-10-5-3-2-4-6-10;1-2/h2-6H,7-8H2,1H3,(H,12,14);2H2,1H3
InChIKeyVXANQINPKUQIFP-UHFFFAOYSA-N
XLogP1.43
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.25
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

acetylene;ethane;N-(2-oxopropyl)-3-phenylpropanamide
CID 170949279
2-phenyl-N-[[(2-phenylacetyl)amino]methyl]acetamide
CID 13210427
benzene;1-phenylpropan-2-one
CID 21430852
2-(2-chlorophenyl)-N-(2-oxopropyl)acetamide
CID 64996556
molecular hydrogen;N-(2-oxobutyl)-2-phenylacetamide
CID 144547081
methyl 2-[[2-[(2-phenylacetyl)amino]acetyl]amino]acetate
CID 23345289
N-(2-bromoprop-2-enyl)-2-phenylacetamide
CID 115594657
trimethylsilyl 2-[(2-phenylacetyl)amino]acetate
CID 523699
N-[2-(2-methylanilino)-2-oxoethyl]-2-phenylacetamide
CID 2224642
N-[2-(2,6-dimethylanilino)-2-oxoethyl]-2-phenylacetamide
CID 7676704
ethane;N-ethyl-2-phenylacetamide;molecular hydrogen
CID 167457544
benzyl 2-[(2-phenylacetyl)amino]acetate
CID 2168453

Frequently Asked Questions

What is the IUPAC name of methylphosphane;N-(2-oxopropyl)-2-phenylacetamide?
The IUPAC name of methylphosphane;N-(2-oxopropyl)-2-phenylacetamide (CID 161423403) is methylphosphane;N-(2-oxopropyl)-2-phenylacetamide.
What is the SMILES notation for methylphosphane;N-(2-oxopropyl)-2-phenylacetamide?
The canonical SMILES for methylphosphane;N-(2-oxopropyl)-2-phenylacetamide is CC(=O)CNC(=O)Cc1ccccc1.CP.
What is the InChIKey of methylphosphane;N-(2-oxopropyl)-2-phenylacetamide?
The InChIKey is VXANQINPKUQIFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO2.CH5P/c1-9(13)8-12-11(14)7-10-5-3-2-4-6-10;1-2/h2-6H,7-8H2,1H3,(H,12,14);2H2,1H3.
What are the key properties of methylphosphane;N-(2-oxopropyl)-2-phenylacetamide?
methylphosphane;N-(2-oxopropyl)-2-phenylacetamide has a molecular weight of 239.25 g/mol, XLogP of 1.43, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methylphosphane;N-(2-oxopropyl)-2-phenylacetamide is sourced from PubChem (CID 161423403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).