N,N-bis(2-diphenylphosphanylethyl)acetamide

C30H31NOP2 — CID 59163449

IUPACN,N-bis(2-diphenylphosphanylethyl)acetamide
SMILESCC(=O)N(CCP(c1ccccc1)c1ccccc1)CCP(c1ccccc1)c1ccccc1
InChIInChI=1S/C30H31NOP2/c1-26(32)31(22-24-33(27-14-6-2-7-15-27)28-16-8-3-9-17-28)23-25-34(29-18-10-4-11-19-29)30-20-12-5-13-21-30/h2-21H,22-25H2,1H3
InChIKeyWAEDCHBGUNJWFZ-UHFFFAOYSA-N
MW483.53 g/mol
LogP5.10
Rot. Bonds10

About N,N-bis(2-diphenylphosphanylethyl)acetamide

N,N-bis(2-diphenylphosphanylethyl)acetamide (PubChem CID 59163449) has the molecular formula C30H31NOP2 and a molecular weight of 483.53 g/mol. Its IUPAC name is N,N-bis(2-diphenylphosphanylethyl)acetamide.

Molecular Properties

Compound NameN,N-bis(2-diphenylphosphanylethyl)acetamide
PubChem CID59163449
Molecular FormulaC30H31NOP2
Molecular Weight483.53 g/mol
Exact Mass483.19
IUPAC NameN,N-bis(2-diphenylphosphanylethyl)acetamide
SMILESCC(=O)N(CCP(c1ccccc1)c1ccccc1)CCP(c1ccccc1)c1ccccc1
InChIInChI=1S/C30H31NOP2/c1-26(32)31(22-24-33(27-14-6-2-7-15-27)28-16-8-3-9-17-28)23-25-34(29-18-10-4-11-19-29)30-20-12-5-13-21-30/h2-21H,22-25H2,1H3
InChIKeyWAEDCHBGUNJWFZ-UHFFFAOYSA-N
XLogP5.10
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500483.53
LogP ≤ 55.10
H-Bond Donors ≤ 50
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 N,N-bis(2-diphenylphosphanylethyl)acetamide?
The IUPAC name of N,N-bis(2-diphenylphosphanylethyl)acetamide (CID 59163449) is N,N-bis(2-diphenylphosphanylethyl)acetamide.
What is the SMILES notation for N,N-bis(2-diphenylphosphanylethyl)acetamide?
The canonical SMILES for N,N-bis(2-diphenylphosphanylethyl)acetamide is CC(=O)N(CCP(c1ccccc1)c1ccccc1)CCP(c1ccccc1)c1ccccc1.
What is the InChIKey of N,N-bis(2-diphenylphosphanylethyl)acetamide?
The InChIKey is WAEDCHBGUNJWFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H31NOP2/c1-26(32)31(22-24-33(27-14-6-2-7-15-27)28-16-8-3-9-17-28)23-25-34(29-18-10-4-11-19-29)30-20-12-5-13-21-30/h2-21H,22-25H2,1H3.
What are the key properties of N,N-bis(2-diphenylphosphanylethyl)acetamide?
N,N-bis(2-diphenylphosphanylethyl)acetamide has a molecular weight of 483.53 g/mol, XLogP of 5.10, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(2-diphenylphosphanylethyl)acetamide is sourced from PubChem (CID 59163449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).