2-dibutylphosphanyl-N,N-dimethylethanamine

C12H28NP — CID 11401687

IUPAC2-dibutylphosphanyl-N,N-dimethylethanamine
SMILESCCCCP(CCCC)CCN(C)C
InChIInChI=1S/C12H28NP/c1-5-7-10-14(11-8-6-2)12-9-13(3)4/h5-12H2,1-4H3
InChIKeySVWRLDLBVZTANY-UHFFFAOYSA-N
MW217.34 g/mol
LogP3.63
Rot. Bonds9

About 2-dibutylphosphanyl-N,N-dimethylethanamine

2-dibutylphosphanyl-N,N-dimethylethanamine (PubChem CID 11401687) has the molecular formula C12H28NP and a molecular weight of 217.34 g/mol. Its IUPAC name is 2-dibutylphosphanyl-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-dibutylphosphanyl-N,N-dimethylethanamine
PubChem CID11401687
Molecular FormulaC12H28NP
Molecular Weight217.34 g/mol
Exact Mass217.20
IUPAC Name2-dibutylphosphanyl-N,N-dimethylethanamine
SMILESCCCCP(CCCC)CCN(C)C
InChIInChI=1S/C12H28NP/c1-5-7-10-14(11-8-6-2)12-9-13(3)4/h5-12H2,1-4H3
InChIKeySVWRLDLBVZTANY-UHFFFAOYSA-N
XLogP3.63
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.34
LogP ≤ 53.63
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 2-dibutylphosphanyl-N,N-dimethylethanamine?
The IUPAC name of 2-dibutylphosphanyl-N,N-dimethylethanamine (CID 11401687) is 2-dibutylphosphanyl-N,N-dimethylethanamine.
What is the SMILES notation for 2-dibutylphosphanyl-N,N-dimethylethanamine?
The canonical SMILES for 2-dibutylphosphanyl-N,N-dimethylethanamine is CCCCP(CCCC)CCN(C)C.
What is the InChIKey of 2-dibutylphosphanyl-N,N-dimethylethanamine?
The InChIKey is SVWRLDLBVZTANY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28NP/c1-5-7-10-14(11-8-6-2)12-9-13(3)4/h5-12H2,1-4H3.
What are the key properties of 2-dibutylphosphanyl-N,N-dimethylethanamine?
2-dibutylphosphanyl-N,N-dimethylethanamine has a molecular weight of 217.34 g/mol, XLogP of 3.63, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibutylphosphanyl-N,N-dimethylethanamine is sourced from PubChem (CID 11401687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).