4,5-dihydroimidazol-1-yl(diphenyl)phosphane

C15H15N2P — CID 91105862

IUPAC4,5-dihydroimidazol-1-yl(diphenyl)phosphane
SMILESC1=NCCN1P(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H15N2P/c1-3-7-14(8-4-1)18(17-12-11-16-13-17)15-9-5-2-6-10-15/h1-10,13H,11-12H2
InChIKeyYAMLNPKMVYFVHK-UHFFFAOYSA-N
MW254.27 g/mol
LogP2.38
Rot. Bonds3

About 4,5-dihydroimidazol-1-yl(diphenyl)phosphane

4,5-dihydroimidazol-1-yl(diphenyl)phosphane (PubChem CID 91105862) has the molecular formula C15H15N2P and a molecular weight of 254.27 g/mol. Its IUPAC name is 4,5-dihydroimidazol-1-yl(diphenyl)phosphane.

Molecular Properties

Compound Name4,5-dihydroimidazol-1-yl(diphenyl)phosphane
PubChem CID91105862
Molecular FormulaC15H15N2P
Molecular Weight254.27 g/mol
Exact Mass254.10
IUPAC Name4,5-dihydroimidazol-1-yl(diphenyl)phosphane
SMILESC1=NCCN1P(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H15N2P/c1-3-7-14(8-4-1)18(17-12-11-16-13-17)15-9-5-2-6-10-15/h1-10,13H,11-12H2
InChIKeyYAMLNPKMVYFVHK-UHFFFAOYSA-N
XLogP2.38
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.27
LogP ≤ 52.38
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 4,5-dihydroimidazol-1-yl(diphenyl)phosphane?
The IUPAC name of 4,5-dihydroimidazol-1-yl(diphenyl)phosphane (CID 91105862) is 4,5-dihydroimidazol-1-yl(diphenyl)phosphane.
What is the SMILES notation for 4,5-dihydroimidazol-1-yl(diphenyl)phosphane?
The canonical SMILES for 4,5-dihydroimidazol-1-yl(diphenyl)phosphane is C1=NCCN1P(c1ccccc1)c1ccccc1.
What is the InChIKey of 4,5-dihydroimidazol-1-yl(diphenyl)phosphane?
The InChIKey is YAMLNPKMVYFVHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N2P/c1-3-7-14(8-4-1)18(17-12-11-16-13-17)15-9-5-2-6-10-15/h1-10,13H,11-12H2.
What are the key properties of 4,5-dihydroimidazol-1-yl(diphenyl)phosphane?
4,5-dihydroimidazol-1-yl(diphenyl)phosphane has a molecular weight of 254.27 g/mol, XLogP of 2.38, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dihydroimidazol-1-yl(diphenyl)phosphane is sourced from PubChem (CID 91105862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).