4-methyl-N-phosphanylpentan-2-amine

C6H16NP — CID 156530755

IUPAC4-methyl-N-phosphanylpentan-2-amine
SMILESCC(C)CC(C)NP
InChIInChI=1S/C6H16NP/c1-5(2)4-6(3)7-8/h5-7H,4,8H2,1-3H3
InChIKeyVNGWDAMKGLWAAS-UHFFFAOYSA-N
MW133.17 g/mol
LogP1.80
Rot. Bonds3

About 4-methyl-N-phosphanylpentan-2-amine

4-methyl-N-phosphanylpentan-2-amine (PubChem CID 156530755) has the molecular formula C6H16NP and a molecular weight of 133.17 g/mol. Its IUPAC name is 4-methyl-N-phosphanylpentan-2-amine.

Molecular Properties

Compound Name4-methyl-N-phosphanylpentan-2-amine
PubChem CID156530755
Molecular FormulaC6H16NP
Molecular Weight133.17 g/mol
Exact Mass133.10
IUPAC Name4-methyl-N-phosphanylpentan-2-amine
SMILESCC(C)CC(C)NP
InChIInChI=1S/C6H16NP/c1-5(2)4-6(3)7-8/h5-7H,4,8H2,1-3H3
InChIKeyVNGWDAMKGLWAAS-UHFFFAOYSA-N
XLogP1.80
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.17
LogP ≤ 51.80
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 4-methyl-N-phosphanylpentan-2-amine?
The IUPAC name of 4-methyl-N-phosphanylpentan-2-amine (CID 156530755) is 4-methyl-N-phosphanylpentan-2-amine.
What is the SMILES notation for 4-methyl-N-phosphanylpentan-2-amine?
The canonical SMILES for 4-methyl-N-phosphanylpentan-2-amine is CC(C)CC(C)NP.
What is the InChIKey of 4-methyl-N-phosphanylpentan-2-amine?
The InChIKey is VNGWDAMKGLWAAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16NP/c1-5(2)4-6(3)7-8/h5-7H,4,8H2,1-3H3.
What are the key properties of 4-methyl-N-phosphanylpentan-2-amine?
4-methyl-N-phosphanylpentan-2-amine has a molecular weight of 133.17 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-phosphanylpentan-2-amine is sourced from PubChem (CID 156530755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).