1-diphenylphosphanylethane-1,2-diamine

C14H17N2P — CID 70150427

IUPAC1-diphenylphosphanylethane-1,2-diamine
SMILESNCC(N)P(c1ccccc1)c1ccccc1
InChIInChI=1S/C14H17N2P/c15-11-14(16)17(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,14H,11,15-16H2
InChIKeyFKHRRLMKFAQKGQ-UHFFFAOYSA-N
MW244.28 g/mol
LogP1.36
Rot. Bonds4

About 1-diphenylphosphanylethane-1,2-diamine

1-diphenylphosphanylethane-1,2-diamine (PubChem CID 70150427) has the molecular formula C14H17N2P and a molecular weight of 244.28 g/mol. Its IUPAC name is 1-diphenylphosphanylethane-1,2-diamine.

Molecular Properties

Compound Name1-diphenylphosphanylethane-1,2-diamine
PubChem CID70150427
Molecular FormulaC14H17N2P
Molecular Weight244.28 g/mol
Exact Mass244.11
IUPAC Name1-diphenylphosphanylethane-1,2-diamine
SMILESNCC(N)P(c1ccccc1)c1ccccc1
InChIInChI=1S/C14H17N2P/c15-11-14(16)17(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,14H,11,15-16H2
InChIKeyFKHRRLMKFAQKGQ-UHFFFAOYSA-N
XLogP1.36
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.28
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-diphenylphosphanylethane-1,2-diamine?
The IUPAC name of 1-diphenylphosphanylethane-1,2-diamine (CID 70150427) is 1-diphenylphosphanylethane-1,2-diamine.
What is the SMILES notation for 1-diphenylphosphanylethane-1,2-diamine?
The canonical SMILES for 1-diphenylphosphanylethane-1,2-diamine is NCC(N)P(c1ccccc1)c1ccccc1.
What is the InChIKey of 1-diphenylphosphanylethane-1,2-diamine?
The InChIKey is FKHRRLMKFAQKGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N2P/c15-11-14(16)17(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,14H,11,15-16H2.
What are the key properties of 1-diphenylphosphanylethane-1,2-diamine?
1-diphenylphosphanylethane-1,2-diamine has a molecular weight of 244.28 g/mol, XLogP of 1.36, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-diphenylphosphanylethane-1,2-diamine is sourced from PubChem (CID 70150427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).