cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide

C10H15P-2 — CID 139170668

IUPACcyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide
SMILESCC(C)(C)C[P-]c1ccc[cH-]1
InChIInChI=1S/C10H15P/c1-10(2,3)8-11-9-6-4-5-7-9/h4-7H,8H2,1-3H3/q-2
InChIKeyLTYKQPUWPKYGPD-UHFFFAOYSA-N
MW166.20 g/mol
LogP3.02
Rot. Bonds2

About cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide

cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide (PubChem CID 139170668) has the molecular formula C10H15P-2 and a molecular weight of 166.20 g/mol. Its IUPAC name is cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide.

Molecular Properties

Compound Namecyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide
PubChem CID139170668
Molecular FormulaC10H15P-2
Molecular Weight166.20 g/mol
Exact Mass166.09
IUPAC Namecyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide
SMILESCC(C)(C)C[P-]c1ccc[cH-]1
InChIInChI=1S/C10H15P/c1-10(2,3)8-11-9-6-4-5-7-9/h4-7H,8H2,1-3H3/q-2
InChIKeyLTYKQPUWPKYGPD-UHFFFAOYSA-N
XLogP3.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.20
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 69597
CID 69597
CID 74149
CID 74149
CID 292611
CID 292611
CID 316378
CID 316378
CID 4568796
CID 4568796
CID 80757
CID 80757
CID 185712
CID 185712
CID 5235501
CID 5235501
CID 2733416
CID 2733416
CID 118855782
CID 118855782
CID 117840
CID 117840
CID 137886
CID 137886

Frequently Asked Questions

What is the IUPAC name of cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide?
The IUPAC name of cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide (CID 139170668) is cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide.
What is the SMILES notation for cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide?
The canonical SMILES for cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide is CC(C)(C)C[P-]c1ccc[cH-]1.
What is the InChIKey of cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide?
The InChIKey is LTYKQPUWPKYGPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15P/c1-10(2,3)8-11-9-6-4-5-7-9/h4-7H,8H2,1-3H3/q-2.
What are the key properties of cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide?
cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide has a molecular weight of 166.20 g/mol, XLogP of 3.02, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide is sourced from PubChem (CID 139170668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).