diphenylphosphanylformamide

C13H12NOP — CID 134897480

IUPACdiphenylphosphanylformamide
SMILESNC(=O)P(c1ccccc1)c1ccccc1
InChIInChI=1S/C13H12NOP/c14-13(15)16(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,(H2,14,15)
InChIKeyXQWQZQPRZHSFCK-UHFFFAOYSA-N
MW229.22 g/mol
LogP2.20
Rot. Bonds3

About diphenylphosphanylformamide

diphenylphosphanylformamide (PubChem CID 134897480) has the molecular formula C13H12NOP and a molecular weight of 229.22 g/mol. Its IUPAC name is diphenylphosphanylformamide.

Molecular Properties

Compound Namediphenylphosphanylformamide
PubChem CID134897480
Molecular FormulaC13H12NOP
Molecular Weight229.22 g/mol
Exact Mass229.07
IUPAC Namediphenylphosphanylformamide
SMILESNC(=O)P(c1ccccc1)c1ccccc1
InChIInChI=1S/C13H12NOP/c14-13(15)16(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,(H2,14,15)
InChIKeyXQWQZQPRZHSFCK-UHFFFAOYSA-N
XLogP2.20
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.22
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of diphenylphosphanylformamide?
The IUPAC name of diphenylphosphanylformamide (CID 134897480) is diphenylphosphanylformamide.
What is the SMILES notation for diphenylphosphanylformamide?
The canonical SMILES for diphenylphosphanylformamide is NC(=O)P(c1ccccc1)c1ccccc1.
What is the InChIKey of diphenylphosphanylformamide?
The InChIKey is XQWQZQPRZHSFCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12NOP/c14-13(15)16(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,(H2,14,15).
What are the key properties of diphenylphosphanylformamide?
diphenylphosphanylformamide has a molecular weight of 229.22 g/mol, XLogP of 2.20, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for diphenylphosphanylformamide is sourced from PubChem (CID 134897480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).