2-(4-methylpyrimidin-2-yl)pentan-2-ylphosphane

C10H17N2P — CID 118344065

IUPAC2-(4-methylpyrimidin-2-yl)pentan-2-ylphosphane
SMILESCCCC(C)(P)c1nccc(C)n1
InChIInChI=1S/C10H17N2P/c1-4-6-10(3,13)9-11-7-5-8(2)12-9/h5,7H,4,6,13H2,1-3H3
InChIKeyRVVQIMCOLKOWHT-UHFFFAOYSA-N
MW196.23 g/mol
LogP2.68
Rot. Bonds3

About 2-(4-methylpyrimidin-2-yl)pentan-2-ylphosphane

2-(4-methylpyrimidin-2-yl)pentan-2-ylphosphane (PubChem CID 118344065) has the molecular formula C10H17N2P and a molecular weight of 196.23 g/mol. Its IUPAC name is 2-(4-methylpyrimidin-2-yl)pentan-2-ylphosphane.

Molecular Properties

Compound Name2-(4-methylpyrimidin-2-yl)pentan-2-ylphosphane
PubChem CID118344065
Molecular FormulaC10H17N2P
Molecular Weight196.23 g/mol
Exact Mass196.11
IUPAC Name2-(4-methylpyrimidin-2-yl)pentan-2-ylphosphane
SMILESCCCC(C)(P)c1nccc(C)n1
InChIInChI=1S/C10H17N2P/c1-4-6-10(3,13)9-11-7-5-8(2)12-9/h5,7H,4,6,13H2,1-3H3
InChIKeyRVVQIMCOLKOWHT-UHFFFAOYSA-N
XLogP2.68
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.23
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-(4-methylpyrimidin-2-yl)pentan-2-ylphosphane?
The IUPAC name of 2-(4-methylpyrimidin-2-yl)pentan-2-ylphosphane (CID 118344065) is 2-(4-methylpyrimidin-2-yl)pentan-2-ylphosphane.
What is the SMILES notation for 2-(4-methylpyrimidin-2-yl)pentan-2-ylphosphane?
The canonical SMILES for 2-(4-methylpyrimidin-2-yl)pentan-2-ylphosphane is CCCC(C)(P)c1nccc(C)n1.
What is the InChIKey of 2-(4-methylpyrimidin-2-yl)pentan-2-ylphosphane?
The InChIKey is RVVQIMCOLKOWHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N2P/c1-4-6-10(3,13)9-11-7-5-8(2)12-9/h5,7H,4,6,13H2,1-3H3.
What are the key properties of 2-(4-methylpyrimidin-2-yl)pentan-2-ylphosphane?
2-(4-methylpyrimidin-2-yl)pentan-2-ylphosphane has a molecular weight of 196.23 g/mol, XLogP of 2.68, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylpyrimidin-2-yl)pentan-2-ylphosphane is sourced from PubChem (CID 118344065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).