2-diphenylphosphanyl-N-methylacetamide

C15H16NOP — CID 15199033

IUPAC2-diphenylphosphanyl-N-methylacetamide
SMILESCNC(=O)CP(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H16NOP/c1-16-15(17)12-18(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11H,12H2,1H3,(H,16,17)
InChIKeyAOZYCPCLYREZGC-UHFFFAOYSA-N
MW257.27 g/mol
LogP1.87
Rot. Bonds4

About 2-diphenylphosphanyl-N-methylacetamide

2-diphenylphosphanyl-N-methylacetamide (PubChem CID 15199033) has the molecular formula C15H16NOP and a molecular weight of 257.27 g/mol. Its IUPAC name is 2-diphenylphosphanyl-N-methylacetamide.

Molecular Properties

Compound Name2-diphenylphosphanyl-N-methylacetamide
PubChem CID15199033
Molecular FormulaC15H16NOP
Molecular Weight257.27 g/mol
Exact Mass257.10
IUPAC Name2-diphenylphosphanyl-N-methylacetamide
SMILESCNC(=O)CP(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H16NOP/c1-16-15(17)12-18(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11H,12H2,1H3,(H,16,17)
InChIKeyAOZYCPCLYREZGC-UHFFFAOYSA-N
XLogP1.87
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.27
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-(Triphenylphosphoranylidene)acetamide
CID 38099
Acetamide, 2-(diphenylphosphinyl)-N-ethyl-
CID 796967
Triphenyl-((2,2,2-trifluoro-acetylamino)-methyl)-phosphonium, chloride
CID 24213148
(2-Amino-2-oxoethyl)-triphenylphosphanium
CID 212893
Diphenylphosphorylacetamide
CID 796633
((2,2-Dimethyl-propionylamino)-methyl)-triphenyl-phosphonium, chloride
CID 126959458
2-Diphenylphosphinothioylacetamide
CID 796912
Acetamide, 2-(diphenylphosphinothioyl)-N,N-diethyl-
CID 796778
Acetamide, N,N-dimethyl-2-(triphenylphosphoranylidene)-
CID 11046257
(2-Carbamoylethyl)diphenylphosphine
CID 14735808
2-(Diphenylphosphoryl)-N,N-dimethylacetamide
CID 14897379
2-diphenylphosphanyl-N,N-dimethylacetamide
CID 15821756

Frequently Asked Questions

What is the IUPAC name of 2-diphenylphosphanyl-N-methylacetamide?
The IUPAC name of 2-diphenylphosphanyl-N-methylacetamide (CID 15199033) is 2-diphenylphosphanyl-N-methylacetamide.
What is the SMILES notation for 2-diphenylphosphanyl-N-methylacetamide?
The canonical SMILES for 2-diphenylphosphanyl-N-methylacetamide is CNC(=O)CP(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-diphenylphosphanyl-N-methylacetamide?
The InChIKey is AOZYCPCLYREZGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16NOP/c1-16-15(17)12-18(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11H,12H2,1H3,(H,16,17).
What are the key properties of 2-diphenylphosphanyl-N-methylacetamide?
2-diphenylphosphanyl-N-methylacetamide has a molecular weight of 257.27 g/mol, XLogP of 1.87, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-diphenylphosphanyl-N-methylacetamide is sourced from PubChem (CID 15199033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).