3,3-dimethyl-2-phosphanylbutan-2-amine

C6H16NP — CID 163664867

IUPAC3,3-dimethyl-2-phosphanylbutan-2-amine
SMILESCC(C)(C)C(C)(N)P
InChIInChI=1S/C6H16NP/c1-5(2,3)6(4,7)8/h7-8H2,1-4H3
InChIKeyIXMMDEVJBXXEBR-UHFFFAOYSA-N
MW133.17 g/mol
LogP1.58
Rot. Bonds

About 3,3-dimethyl-2-phosphanylbutan-2-amine

3,3-dimethyl-2-phosphanylbutan-2-amine (PubChem CID 163664867) has the molecular formula C6H16NP and a molecular weight of 133.17 g/mol. Its IUPAC name is 3,3-dimethyl-2-phosphanylbutan-2-amine.

Molecular Properties

Compound Name3,3-dimethyl-2-phosphanylbutan-2-amine
PubChem CID163664867
Molecular FormulaC6H16NP
Molecular Weight133.17 g/mol
Exact Mass133.10
IUPAC Name3,3-dimethyl-2-phosphanylbutan-2-amine
SMILESCC(C)(C)C(C)(N)P
InChIInChI=1S/C6H16NP/c1-5(2,3)6(4,7)8/h7-8H2,1-4H3
InChIKeyIXMMDEVJBXXEBR-UHFFFAOYSA-N
XLogP1.58
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.17
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-(2,4,4-Trimethylpentan-2-ylphosphanyl)propan-2-amine
CID 163885236

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-2-phosphanylbutan-2-amine?
The IUPAC name of 3,3-dimethyl-2-phosphanylbutan-2-amine (CID 163664867) is 3,3-dimethyl-2-phosphanylbutan-2-amine.
What is the SMILES notation for 3,3-dimethyl-2-phosphanylbutan-2-amine?
The canonical SMILES for 3,3-dimethyl-2-phosphanylbutan-2-amine is CC(C)(C)C(C)(N)P.
What is the InChIKey of 3,3-dimethyl-2-phosphanylbutan-2-amine?
The InChIKey is IXMMDEVJBXXEBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16NP/c1-5(2,3)6(4,7)8/h7-8H2,1-4H3.
What are the key properties of 3,3-dimethyl-2-phosphanylbutan-2-amine?
3,3-dimethyl-2-phosphanylbutan-2-amine has a molecular weight of 133.17 g/mol, XLogP of 1.58, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-2-phosphanylbutan-2-amine is sourced from PubChem (CID 163664867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).