2-(2,4,4-trimethylpentan-2-ylphosphanyl)propan-2-amine

C11H26NP — CID 163885236

IUPAC2-(2,4,4-trimethylpentan-2-ylphosphanyl)propan-2-amine
SMILESCC(C)(C)CC(C)(C)PC(C)(C)N
InChIInChI=1S/C11H26NP/c1-9(2,3)8-10(4,5)13-11(6,7)12/h13H,8,12H2,1-7H3
InChIKeyPWTUYCSGMWDKAF-UHFFFAOYSA-N
MW203.31 g/mol
LogP3.57
Rot. Bonds3

About 2-(2,4,4-trimethylpentan-2-ylphosphanyl)propan-2-amine

2-(2,4,4-trimethylpentan-2-ylphosphanyl)propan-2-amine (PubChem CID 163885236) has the molecular formula C11H26NP and a molecular weight of 203.31 g/mol. Its IUPAC name is 2-(2,4,4-trimethylpentan-2-ylphosphanyl)propan-2-amine.

Molecular Properties

Compound Name2-(2,4,4-trimethylpentan-2-ylphosphanyl)propan-2-amine
PubChem CID163885236
Molecular FormulaC11H26NP
Molecular Weight203.31 g/mol
Exact Mass203.18
IUPAC Name2-(2,4,4-trimethylpentan-2-ylphosphanyl)propan-2-amine
SMILESCC(C)(C)CC(C)(C)PC(C)(C)N
InChIInChI=1S/C11H26NP/c1-9(2,3)8-10(4,5)13-11(6,7)12/h13H,8,12H2,1-7H3
InChIKeyPWTUYCSGMWDKAF-UHFFFAOYSA-N
XLogP3.57
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.31
LogP ≤ 53.57
H-Bond Donors ≤ 51
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-(2,4,4-trimethylpentan-2-ylphosphanyl)propan-2-amine?
The IUPAC name of 2-(2,4,4-trimethylpentan-2-ylphosphanyl)propan-2-amine (CID 163885236) is 2-(2,4,4-trimethylpentan-2-ylphosphanyl)propan-2-amine.
What is the SMILES notation for 2-(2,4,4-trimethylpentan-2-ylphosphanyl)propan-2-amine?
The canonical SMILES for 2-(2,4,4-trimethylpentan-2-ylphosphanyl)propan-2-amine is CC(C)(C)CC(C)(C)PC(C)(C)N.
What is the InChIKey of 2-(2,4,4-trimethylpentan-2-ylphosphanyl)propan-2-amine?
The InChIKey is PWTUYCSGMWDKAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26NP/c1-9(2,3)8-10(4,5)13-11(6,7)12/h13H,8,12H2,1-7H3.
What are the key properties of 2-(2,4,4-trimethylpentan-2-ylphosphanyl)propan-2-amine?
2-(2,4,4-trimethylpentan-2-ylphosphanyl)propan-2-amine has a molecular weight of 203.31 g/mol, XLogP of 3.57, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4,4-trimethylpentan-2-ylphosphanyl)propan-2-amine is sourced from PubChem (CID 163885236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).