2-phosphanyl-N-(2-phosphanylethyl)ethanamine

C4H13NP2 — CID 533912

IUPAC2-phosphanyl-N-(2-phosphanylethyl)ethanamine
SMILESPCCNCCP
InChIInChI=1S/C4H13NP2/c6-3-1-5-2-4-7/h5H,1-4,6-7H2
InChIKeyYFQQNHSQGYNJIL-UHFFFAOYSA-N
MW137.10 g/mol
LogP0.33
Rot. Bonds4

About 2-phosphanyl-N-(2-phosphanylethyl)ethanamine

2-phosphanyl-N-(2-phosphanylethyl)ethanamine (PubChem CID 533912) has the molecular formula C4H13NP2 and a molecular weight of 137.10 g/mol. Its IUPAC name is 2-phosphanyl-N-(2-phosphanylethyl)ethanamine.

Molecular Properties

Compound Name2-phosphanyl-N-(2-phosphanylethyl)ethanamine
PubChem CID533912
Molecular FormulaC4H13NP2
Molecular Weight137.10 g/mol
Exact Mass137.05
IUPAC Name2-phosphanyl-N-(2-phosphanylethyl)ethanamine
SMILESPCCNCCP
InChIInChI=1S/C4H13NP2/c6-3-1-5-2-4-7/h5H,1-4,6-7H2
InChIKeyYFQQNHSQGYNJIL-UHFFFAOYSA-N
XLogP0.33
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.10
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Amine, N,N-bis[2-(methylphosphino)ethyl]-
CID 5366868
N-(2-phosphanylethyl)propan-1-amine
CID 58997739
N'-(2-phosphanylethyl)ethane-1,2-diamine
CID 88508735
N-ethyl-3-phosphanylpropan-1-amine
CID 89758824
N-ethyl-1-phosphanylethanamine
CID 90730518
N-ethyl-2-phosphanylethanamine
CID 91132910
(1R)-N-ethyl-1-phosphanylethanamine
CID 121458893
2-(Ethylamino)ethylidynephosphanium
CID 123827575
N-(1-phosphanylethyl)propan-1-amine
CID 124003928
1-ethylphosphanyl-N-methylethanamine
CID 124017780
N-methyl-1-methylphosphanylethanamine
CID 144537771
N-methyl-2-methylphosphanylethanamine
CID 170126111

Frequently Asked Questions

What is the IUPAC name of 2-phosphanyl-N-(2-phosphanylethyl)ethanamine?
The IUPAC name of 2-phosphanyl-N-(2-phosphanylethyl)ethanamine (CID 533912) is 2-phosphanyl-N-(2-phosphanylethyl)ethanamine.
What is the SMILES notation for 2-phosphanyl-N-(2-phosphanylethyl)ethanamine?
The canonical SMILES for 2-phosphanyl-N-(2-phosphanylethyl)ethanamine is PCCNCCP.
What is the InChIKey of 2-phosphanyl-N-(2-phosphanylethyl)ethanamine?
The InChIKey is YFQQNHSQGYNJIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H13NP2/c6-3-1-5-2-4-7/h5H,1-4,6-7H2.
What are the key properties of 2-phosphanyl-N-(2-phosphanylethyl)ethanamine?
2-phosphanyl-N-(2-phosphanylethyl)ethanamine has a molecular weight of 137.10 g/mol, XLogP of 0.33, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phosphanyl-N-(2-phosphanylethyl)ethanamine is sourced from PubChem (CID 533912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).