1-methyl-4-phenyl-1,4-azaphosphinane

C11H16NP — CID 71365636

IUPAC1-methyl-4-phenyl-1,4-azaphosphinane
SMILESCN1CCP(c2ccccc2)CC1
InChIInChI=1S/C11H16NP/c1-12-7-9-13(10-8-12)11-5-3-2-4-6-11/h2-6H,7-10H2,1H3
InChIKeyXRAGCZYNIIWTSW-UHFFFAOYSA-N
MW193.23 g/mol
LogP1.74
Rot. Bonds1

About 1-methyl-4-phenyl-1,4-azaphosphinane

1-methyl-4-phenyl-1,4-azaphosphinane (PubChem CID 71365636) has the molecular formula C11H16NP and a molecular weight of 193.23 g/mol. Its IUPAC name is 1-methyl-4-phenyl-1,4-azaphosphinane.

Molecular Properties

Compound Name1-methyl-4-phenyl-1,4-azaphosphinane
PubChem CID71365636
Molecular FormulaC11H16NP
Molecular Weight193.23 g/mol
Exact Mass193.10
IUPAC Name1-methyl-4-phenyl-1,4-azaphosphinane
SMILESCN1CCP(c2ccccc2)CC1
InChIInChI=1S/C11H16NP/c1-12-7-9-13(10-8-12)11-5-3-2-4-6-11/h2-6H,7-10H2,1H3
InChIKeyXRAGCZYNIIWTSW-UHFFFAOYSA-N
XLogP1.74
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.23
LogP ≤ 51.74
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 1-methyl-4-phenyl-1,4-azaphosphinane?
The IUPAC name of 1-methyl-4-phenyl-1,4-azaphosphinane (CID 71365636) is 1-methyl-4-phenyl-1,4-azaphosphinane.
What is the SMILES notation for 1-methyl-4-phenyl-1,4-azaphosphinane?
The canonical SMILES for 1-methyl-4-phenyl-1,4-azaphosphinane is CN1CCP(c2ccccc2)CC1.
What is the InChIKey of 1-methyl-4-phenyl-1,4-azaphosphinane?
The InChIKey is XRAGCZYNIIWTSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16NP/c1-12-7-9-13(10-8-12)11-5-3-2-4-6-11/h2-6H,7-10H2,1H3.
What are the key properties of 1-methyl-4-phenyl-1,4-azaphosphinane?
1-methyl-4-phenyl-1,4-azaphosphinane has a molecular weight of 193.23 g/mol, XLogP of 1.74, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-phenyl-1,4-azaphosphinane is sourced from PubChem (CID 71365636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).