lithium;cyclohexylphosphanyl-(2,6-dimethoxyphenyl)methanone;hydride

C15H22LiO3P — CID 174401232

IUPAClithium;cyclohexylphosphanyl-(2,6-dimethoxyphenyl)methanone;hydride
SMILESCOc1cccc(OC)c1C(=O)PC1CCCCC1.[H-].[Li+]
InChIInChI=1S/C15H21O3P.Li.H/c1-17-12-9-6-10-13(18-2)14(12)15(16)19-11-7-4-3-5-8-11;;/h6,9-11,19H,3-5,7-8H2,1-2H3;;/q;+1;-1
InChIKeyLVHLZOGVBMCBSR-UHFFFAOYSA-N
MW288.25 g/mol
LogP0.97
Rot. Bonds5

About lithium;cyclohexylphosphanyl-(2,6-dimethoxyphenyl)methanone;hydride

lithium;cyclohexylphosphanyl-(2,6-dimethoxyphenyl)methanone;hydride (PubChem CID 174401232) has the molecular formula C15H22LiO3P and a molecular weight of 288.25 g/mol. Its IUPAC name is lithium;cyclohexylphosphanyl-(2,6-dimethoxyphenyl)methanone;hydride.

Molecular Properties

Compound Namelithium;cyclohexylphosphanyl-(2,6-dimethoxyphenyl)methanone;hydride
PubChem CID174401232
Molecular FormulaC15H22LiO3P
Molecular Weight288.25 g/mol
Exact Mass288.15
IUPAC Namelithium;cyclohexylphosphanyl-(2,6-dimethoxyphenyl)methanone;hydride
SMILESCOc1cccc(OC)c1C(=O)PC1CCCCC1.[H-].[Li+]
InChIInChI=1S/C15H21O3P.Li.H/c1-17-12-9-6-10-13(18-2)14(12)15(16)19-11-7-4-3-5-8-11;;/h6,9-11,19H,3-5,7-8H2,1-2H3;;/q;+1;-1
InChIKeyLVHLZOGVBMCBSR-UHFFFAOYSA-N
XLogP0.97
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.25
LogP ≤ 50.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze lithium;cyclohexylphosphanyl-(2,6-dimethoxyphenyl)methanone;hydride 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

lithium;cyclopentylphosphanyl-(2,6-dimethoxy-4-methylphenyl)methanone;hydride
CID 174440508
cycloheptyl-(2,6-dimethoxyphenyl)methanone
CID 116810005
lithium;cyclopentylphosphanyl-(2,3,6-trimethylphenyl)methanone;hydride
CID 174463897
CID 159051946
CID 159051946
CID 159103638
CID 159103638
[cyclohexyl-(2,6-diethoxybenzoyl)phosphanyl]-(2,6-dimethoxyphenyl)methanone
CID 151634798
lithium;(2,6-dimethoxyphenyl)-(2-methylpropylphosphanyl)methanone;hydride
CID 174399349
lithium (2,6-dimethoxyphenyl)-(2,6-dimethylphenyl)phosphanylmethanone
CID 18514916
N-cyclopentyloxy-2,6-dimethoxybenzamide
CID 83216402
[tert-butyl(cyclohexyl)phosphoryl]-(2,6-dimethoxyphenyl)methanone
CID 22183998
N-[(1R,2R)-2-hydroxycyclohexyl]-2,6-dimethoxybenzamide
CID 104928008
cyclohexyl-(2,3-dimethoxyphenyl)methanone
CID 105076806

Frequently Asked Questions

What is the IUPAC name of lithium;cyclohexylphosphanyl-(2,6-dimethoxyphenyl)methanone;hydride?
The IUPAC name of lithium;cyclohexylphosphanyl-(2,6-dimethoxyphenyl)methanone;hydride (CID 174401232) is lithium;cyclohexylphosphanyl-(2,6-dimethoxyphenyl)methanone;hydride.
What is the SMILES notation for lithium;cyclohexylphosphanyl-(2,6-dimethoxyphenyl)methanone;hydride?
The canonical SMILES for lithium;cyclohexylphosphanyl-(2,6-dimethoxyphenyl)methanone;hydride is COc1cccc(OC)c1C(=O)PC1CCCCC1.[H-].[Li+].
What is the InChIKey of lithium;cyclohexylphosphanyl-(2,6-dimethoxyphenyl)methanone;hydride?
The InChIKey is LVHLZOGVBMCBSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21O3P.Li.H/c1-17-12-9-6-10-13(18-2)14(12)15(16)19-11-7-4-3-5-8-11;;/h6,9-11,19H,3-5,7-8H2,1-2H3;;/q;+1;-1.
What are the key properties of lithium;cyclohexylphosphanyl-(2,6-dimethoxyphenyl)methanone;hydride?
lithium;cyclohexylphosphanyl-(2,6-dimethoxyphenyl)methanone;hydride has a molecular weight of 288.25 g/mol, XLogP of 0.97, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;cyclohexylphosphanyl-(2,6-dimethoxyphenyl)methanone;hydride is sourced from PubChem (CID 174401232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).