2-(4,5-dimethyl-2-pyridinyl)propan-2-ylphosphane

C10H16NP — CID 170234935

IUPAC2-(4,5-dimethyl-2-pyridinyl)propan-2-ylphosphane
SMILESCc1cnc(C(C)(C)P)cc1C
InChIInChI=1S/C10H16NP/c1-7-5-9(10(3,4)12)11-6-8(7)2/h5-6H,12H2,1-4H3
InChIKeyZDSVMPNMPGGDCT-UHFFFAOYSA-N
MW181.22 g/mol
LogP2.81
Rot. Bonds1

About 2-(4,5-dimethyl-2-pyridinyl)propan-2-ylphosphane

2-(4,5-dimethyl-2-pyridinyl)propan-2-ylphosphane (PubChem CID 170234935) has the molecular formula C10H16NP and a molecular weight of 181.22 g/mol. Its IUPAC name is 2-(4,5-dimethyl-2-pyridinyl)propan-2-ylphosphane.

Molecular Properties

Compound Name2-(4,5-dimethyl-2-pyridinyl)propan-2-ylphosphane
PubChem CID170234935
Molecular FormulaC10H16NP
Molecular Weight181.22 g/mol
Exact Mass181.10
IUPAC Name2-(4,5-dimethyl-2-pyridinyl)propan-2-ylphosphane
SMILESCc1cnc(C(C)(C)P)cc1C
InChIInChI=1S/C10H16NP/c1-7-5-9(10(3,4)12)11-6-8(7)2/h5-6H,12H2,1-4H3
InChIKeyZDSVMPNMPGGDCT-UHFFFAOYSA-N
XLogP2.81
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.22
LogP ≤ 52.81
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-(4,5-dimethyl-2-pyridinyl)propan-2-ylphosphane?
The IUPAC name of 2-(4,5-dimethyl-2-pyridinyl)propan-2-ylphosphane (CID 170234935) is 2-(4,5-dimethyl-2-pyridinyl)propan-2-ylphosphane.
What is the SMILES notation for 2-(4,5-dimethyl-2-pyridinyl)propan-2-ylphosphane?
The canonical SMILES for 2-(4,5-dimethyl-2-pyridinyl)propan-2-ylphosphane is Cc1cnc(C(C)(C)P)cc1C.
What is the InChIKey of 2-(4,5-dimethyl-2-pyridinyl)propan-2-ylphosphane?
The InChIKey is ZDSVMPNMPGGDCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16NP/c1-7-5-9(10(3,4)12)11-6-8(7)2/h5-6H,12H2,1-4H3.
What are the key properties of 2-(4,5-dimethyl-2-pyridinyl)propan-2-ylphosphane?
2-(4,5-dimethyl-2-pyridinyl)propan-2-ylphosphane has a molecular weight of 181.22 g/mol, XLogP of 2.81, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,5-dimethyl-2-pyridinyl)propan-2-ylphosphane is sourced from PubChem (CID 170234935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).