[2-(diphenylarsanylmethyl)cyclopentyl]methyl-diphenylarsane

C31H32As2 — CID 152745173

IUPAC[2-(diphenylarsanylmethyl)cyclopentyl]methyl-diphenylarsane
SMILESc1ccc([As](CC2CCCC2C[As](c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C31H32As2/c1-5-16-28(17-6-1)32(29-18-7-2-8-19-29)24-26-14-13-15-27(26)25-33(30-20-9-3-10-21-30)31-22-11-4-12-23-31/h1-12,16-23,26-27H,13-15,24-25H2
InChIKeyGLJJKSUTYFFUMO-UHFFFAOYSA-N
MW554.44 g/mol
LogP5.02
Rot. Bonds8

About [2-(diphenylarsanylmethyl)cyclopentyl]methyl-diphenylarsane

[2-(diphenylarsanylmethyl)cyclopentyl]methyl-diphenylarsane (PubChem CID 152745173) has the molecular formula C31H32As2 and a molecular weight of 554.44 g/mol. Its IUPAC name is [2-(diphenylarsanylmethyl)cyclopentyl]methyl-diphenylarsane.

Molecular Properties

Compound Name[2-(diphenylarsanylmethyl)cyclopentyl]methyl-diphenylarsane
PubChem CID152745173
Molecular FormulaC31H32As2
Molecular Weight554.44 g/mol
Exact Mass554.09
IUPAC Name[2-(diphenylarsanylmethyl)cyclopentyl]methyl-diphenylarsane
SMILESc1ccc([As](CC2CCCC2C[As](c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C31H32As2/c1-5-16-28(17-6-1)32(29-18-7-2-8-19-29)24-26-14-13-15-27(26)25-33(30-20-9-3-10-21-30)31-22-11-4-12-23-31/h1-12,16-23,26-27H,13-15,24-25H2
InChIKeyGLJJKSUTYFFUMO-UHFFFAOYSA-N
XLogP5.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500554.44
LogP ≤ 55.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze [2-(diphenylarsanylmethyl)cyclopentyl]methyl-diphenylarsane 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

cis-(1S,2R)-2-(2-phenylethyl)cyclopentan-1-amine
CID 92754802
cis-(1R,2S)-2-(2-phenylethyl)cyclopentan-1-amine
CID 92754803
2-[(1R)-2-(6-phenylhexyl)cyclopentyl]ethanol
CID 142188842
2,3,3a,4,5,6,7,7a-octahydro-1H-indene;naphthalene
CID 159909847
N-[(2-methylcyclopentyl)methyl]-1-phenylethanamine
CID 107417351
[2-(2-phenylethylamino)cyclopentyl]methanol
CID 104864522
[(2S,3S)-2-phenyloxan-3-yl]methanamine
CID 51892912
ethene;[2-(hydroxymethyl)cyclopentyl]methanol;styrene
CID 162435875
2-[[methyl(2-phenylethyl)amino]methyl]cyclopentan-1-amine
CID 65487102
2-[(2-phenylprop-2-enylamino)methyl]cyclopentan-1-ol
CID 115328361
N-[(2-benzylcyclopentyl)methyl]-2-methylpropan-1-amine
CID 81028227
2-cyclobutyloxyethylbenzene
CID 54003575

Frequently Asked Questions

What is the IUPAC name of [2-(diphenylarsanylmethyl)cyclopentyl]methyl-diphenylarsane?
The IUPAC name of [2-(diphenylarsanylmethyl)cyclopentyl]methyl-diphenylarsane (CID 152745173) is [2-(diphenylarsanylmethyl)cyclopentyl]methyl-diphenylarsane.
What is the SMILES notation for [2-(diphenylarsanylmethyl)cyclopentyl]methyl-diphenylarsane?
The canonical SMILES for [2-(diphenylarsanylmethyl)cyclopentyl]methyl-diphenylarsane is c1ccc([As](CC2CCCC2C[As](c2ccccc2)c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of [2-(diphenylarsanylmethyl)cyclopentyl]methyl-diphenylarsane?
The InChIKey is GLJJKSUTYFFUMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H32As2/c1-5-16-28(17-6-1)32(29-18-7-2-8-19-29)24-26-14-13-15-27(26)25-33(30-20-9-3-10-21-30)31-22-11-4-12-23-31/h1-12,16-23,26-27H,13-15,24-25H2.
What are the key properties of [2-(diphenylarsanylmethyl)cyclopentyl]methyl-diphenylarsane?
[2-(diphenylarsanylmethyl)cyclopentyl]methyl-diphenylarsane has a molecular weight of 554.44 g/mol, XLogP of 5.02, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(diphenylarsanylmethyl)cyclopentyl]methyl-diphenylarsane is sourced from PubChem (CID 152745173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).