(1,2-dimethyl-2-phenylcyclopropyl)benzene

C17H18 — CID 3657661

IUPAC(1,2-dimethyl-2-phenylcyclopropyl)benzene
SMILESCC1(c2ccccc2)CC1(C)c1ccccc1
InChIInChI=1S/C17H18/c1-16(14-9-5-3-6-10-14)13-17(16,2)15-11-7-4-8-12-15/h3-12H,13H2,1-2H3
InChIKeyHXAAXPCCMXWUGY-UHFFFAOYSA-N
MW222.33 g/mol
LogP4.31
Rot. Bonds2

About (1,2-dimethyl-2-phenylcyclopropyl)benzene

(1,2-dimethyl-2-phenylcyclopropyl)benzene (PubChem CID 3657661) has the molecular formula C17H18 and a molecular weight of 222.33 g/mol. Its IUPAC name is (1,2-dimethyl-2-phenylcyclopropyl)benzene.

Molecular Properties

Compound Name(1,2-dimethyl-2-phenylcyclopropyl)benzene
PubChem CID3657661
Molecular FormulaC17H18
Molecular Weight222.33 g/mol
Exact Mass222.14
IUPAC Name(1,2-dimethyl-2-phenylcyclopropyl)benzene
SMILESCC1(c2ccccc2)CC1(C)c1ccccc1
InChIInChI=1S/C17H18/c1-16(14-9-5-3-6-10-14)13-17(16,2)15-11-7-4-8-12-15/h3-12H,13H2,1-2H3
InChIKeyHXAAXPCCMXWUGY-UHFFFAOYSA-N
XLogP4.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze (1,2-dimethyl-2-phenylcyclopropyl)benzene with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1,2-dimethyl-2-phenylcyclopropyl)benzene?
The IUPAC name of (1,2-dimethyl-2-phenylcyclopropyl)benzene (CID 3657661) is (1,2-dimethyl-2-phenylcyclopropyl)benzene.
What is the SMILES notation for (1,2-dimethyl-2-phenylcyclopropyl)benzene?
The canonical SMILES for (1,2-dimethyl-2-phenylcyclopropyl)benzene is CC1(c2ccccc2)CC1(C)c1ccccc1.
What is the InChIKey of (1,2-dimethyl-2-phenylcyclopropyl)benzene?
The InChIKey is HXAAXPCCMXWUGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18/c1-16(14-9-5-3-6-10-14)13-17(16,2)15-11-7-4-8-12-15/h3-12H,13H2,1-2H3.
What are the key properties of (1,2-dimethyl-2-phenylcyclopropyl)benzene?
(1,2-dimethyl-2-phenylcyclopropyl)benzene has a molecular weight of 222.33 g/mol, XLogP of 4.31, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1,2-dimethyl-2-phenylcyclopropyl)benzene is sourced from PubChem (CID 3657661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).