N-[amino-(diethylamino)-diethyl-λ5-phosphanyl]-N-ethylethanamine

C12H32N3P — CID 57102514

IUPACN-[amino-(diethylamino)-diethyl-λ5-phosphanyl]-N-ethylethanamine
SMILESCCN(CC)P(N)(CC)(CC)N(CC)CC
InChIInChI=1S/C12H32N3P/c1-7-14(8-2)16(13,11-5,12-6)15(9-3)10-4/h7-13H2,1-6H3
InChIKeyMLIDHZCMCZZSMN-UHFFFAOYSA-N
MW249.38 g/mol
LogP2.97
Rot. Bonds8

About N-[amino-(diethylamino)-diethyl-λ5-phosphanyl]-N-ethylethanamine

N-[amino-(diethylamino)-diethyl-λ5-phosphanyl]-N-ethylethanamine (PubChem CID 57102514) has the molecular formula C12H32N3P and a molecular weight of 249.38 g/mol. Its IUPAC name is N-[amino-(diethylamino)-diethyl-λ5-phosphanyl]-N-ethylethanamine.

Molecular Properties

Compound NameN-[amino-(diethylamino)-diethyl-λ5-phosphanyl]-N-ethylethanamine
PubChem CID57102514
Molecular FormulaC12H32N3P
Molecular Weight249.38 g/mol
Exact Mass249.23
IUPAC NameN-[amino-(diethylamino)-diethyl-λ5-phosphanyl]-N-ethylethanamine
SMILESCCN(CC)P(N)(CC)(CC)N(CC)CC
InChIInChI=1S/C12H32N3P/c1-7-14(8-2)16(13,11-5,12-6)15(9-3)10-4/h7-13H2,1-6H3
InChIKeyMLIDHZCMCZZSMN-UHFFFAOYSA-N
XLogP2.97
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-[amino-(diethylamino)-diethyl-λ5-phosphanyl]-N-ethylethanamine?
The IUPAC name of N-[amino-(diethylamino)-diethyl-λ5-phosphanyl]-N-ethylethanamine (CID 57102514) is N-[amino-(diethylamino)-diethyl-λ5-phosphanyl]-N-ethylethanamine.
What is the SMILES notation for N-[amino-(diethylamino)-diethyl-λ5-phosphanyl]-N-ethylethanamine?
The canonical SMILES for N-[amino-(diethylamino)-diethyl-λ5-phosphanyl]-N-ethylethanamine is CCN(CC)P(N)(CC)(CC)N(CC)CC.
What is the InChIKey of N-[amino-(diethylamino)-diethyl-λ5-phosphanyl]-N-ethylethanamine?
The InChIKey is MLIDHZCMCZZSMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H32N3P/c1-7-14(8-2)16(13,11-5,12-6)15(9-3)10-4/h7-13H2,1-6H3.
What are the key properties of N-[amino-(diethylamino)-diethyl-λ5-phosphanyl]-N-ethylethanamine?
N-[amino-(diethylamino)-diethyl-λ5-phosphanyl]-N-ethylethanamine has a molecular weight of 249.38 g/mol, XLogP of 2.97, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[amino-(diethylamino)-diethyl-λ5-phosphanyl]-N-ethylethanamine is sourced from PubChem (CID 57102514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).