cyclopropane;hexakis(1,3-dimethylbicyclo[1.1.0]butane);1,1-dimethylcyclopropane;ethane;bis(1-methylbicyclo[1.1.0]butane)

C90H170 — CID 160943515

IUPACcyclopropane;hexakis(1,3-dimethylbicyclo[1.1.0]butane);1,1-dimethylcyclopropane;ethane;bis(1-methylbicyclo[1.1.0]butane)
SMILESC1CC1.C1CC1.C1CC1.C1CC1.C1CC1.C1CC1.C1CC1.C1CC1.C1CC1.C1CC1.C1CC1.CC.CC.CC.CC1(C)CC1.CC12CC1(C)C2.CC12CC1(C)C2.CC12CC1(C)C2.CC12CC1(C)C2.CC12CC1(C)C2.CC12CC1(C)C2.CC12CC1C2.CC12CC1C2
InChIInChI=1S/6C6H10.2C5H8.C5H10.11C3H6.3C2H6/c6*1-5-3-6(5,2)4-5;2*1-5-2-4(5)3-5;1-5(2)3-4-5;11*1-2-3-1;3*1-2/h6*3-4H2,1-2H3;2*4H,2-3H2,1H3;3-4H2,1-2H3;11*1-3H2;3*1-2H3
InChIKeySUUWOYNARSTATM-UHFFFAOYSA-N
MW1252.35 g/mol
LogP31.43
Rot. Bonds

About cyclopropane;hexakis(1,3-dimethylbicyclo[1.1.0]butane);1,1-dimethylcyclopropane;ethane;bis(1-methylbicyclo[1.1.0]butane)

cyclopropane;hexakis(1,3-dimethylbicyclo[1.1.0]butane);1,1-dimethylcyclopropane;ethane;bis(1-methylbicyclo[1.1.0]butane) (PubChem CID 160943515) has the molecular formula C90H170 and a molecular weight of 1252.35 g/mol. Its IUPAC name is cyclopropane;hexakis(1,3-dimethylbicyclo[1.1.0]butane);1,1-dimethylcyclopropane;ethane;bis(1-methylbicyclo[1.1.0]butane).

Molecular Properties

Compound Namecyclopropane;hexakis(1,3-dimethylbicyclo[1.1.0]butane);1,1-dimethylcyclopropane;ethane;bis(1-methylbicyclo[1.1.0]butane)
PubChem CID160943515
Molecular FormulaC90H170
Molecular Weight1252.35 g/mol
Exact Mass1251.33
IUPAC Namecyclopropane;hexakis(1,3-dimethylbicyclo[1.1.0]butane);1,1-dimethylcyclopropane;ethane;bis(1-methylbicyclo[1.1.0]butane)
SMILESC1CC1.C1CC1.C1CC1.C1CC1.C1CC1.C1CC1.C1CC1.C1CC1.C1CC1.C1CC1.C1CC1.CC.CC.CC.CC1(C)CC1.CC12CC1(C)C2.CC12CC1(C)C2.CC12CC1(C)C2.CC12CC1(C)C2.CC12CC1(C)C2.CC12CC1(C)C2.CC12CC1C2.CC12CC1C2
InChIInChI=1S/6C6H10.2C5H8.C5H10.11C3H6.3C2H6/c6*1-5-3-6(5,2)4-5;2*1-5-2-4(5)3-5;1-5(2)3-4-5;11*1-2-3-1;3*1-2/h6*3-4H2,1-2H3;2*4H,2-3H2,1H3;3-4H2,1-2H3;11*1-3H2;3*1-2H3
InChIKeySUUWOYNARSTATM-UHFFFAOYSA-N
XLogP31.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms90
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001252.35
LogP ≤ 531.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze cyclopropane;hexakis(1,3-dimethylbicyclo[1.1.0]butane);1,1-dimethylcyclopropane;ethane;bis(1-methylbicyclo[1.1.0]butane) 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

2-cyclohexyl-2-methylspiro[2.5]octane;ethane
CID 145105367
1,1-dimethylcyclononane
CID 59289773
1,1,7,7-tetramethylcyclopentadecane
CID 123360096
(1-methylcyclopentyl)cyclohexane
CID 13217819
1,1-dimethylcyclohexane;methane
CID 160770296
azane;1,1-dimethylcyclohexane
CID 90411117
1,1-dimethylcyclobutane;1,1-dimethylcyclohexane;1,1-dimethylcyclopentane;1,1-dimethylcyclopropane;1,1,2-trimethylcyclopropane
CID 158329208
(1,3-dimethylcyclobutyl)cyclopentane
CID 146720306
7-methyltricyclo[5.4.0.01,10]undecane
CID 123887295
1,1-dimethylcyclobutane;vanadium
CID 158712416
ethane;1,1,3-trimethylcyclohexane;(3S)-1,1,3-trimethylcyclohexane
CID 169190752
(3-chloro-1-methylcyclopentyl)cycloheptane
CID 116540220

Frequently Asked Questions

What is the IUPAC name of cyclopropane;hexakis(1,3-dimethylbicyclo[1.1.0]butane);1,1-dimethylcyclopropane;ethane;bis(1-methylbicyclo[1.1.0]butane)?
The IUPAC name of cyclopropane;hexakis(1,3-dimethylbicyclo[1.1.0]butane);1,1-dimethylcyclopropane;ethane;bis(1-methylbicyclo[1.1.0]butane) (CID 160943515) is cyclopropane;hexakis(1,3-dimethylbicyclo[1.1.0]butane);1,1-dimethylcyclopropane;ethane;bis(1-methylbicyclo[1.1.0]butane).
What is the SMILES notation for cyclopropane;hexakis(1,3-dimethylbicyclo[1.1.0]butane);1,1-dimethylcyclopropane;ethane;bis(1-methylbicyclo[1.1.0]butane)?
The canonical SMILES for cyclopropane;hexakis(1,3-dimethylbicyclo[1.1.0]butane);1,1-dimethylcyclopropane;ethane;bis(1-methylbicyclo[1.1.0]butane) is C1CC1.C1CC1.C1CC1.C1CC1.C1CC1.C1CC1.C1CC1.C1CC1.C1CC1.C1CC1.C1CC1.CC.CC.CC.CC1(C)CC1.CC12CC1(C)C2.CC12CC1(C)C2.CC12CC1(C)C2.CC12CC1(C)C2.CC12CC1(C)C2.CC12CC1(C)C2.CC12CC1C2.CC12CC1C2.
What is the InChIKey of cyclopropane;hexakis(1,3-dimethylbicyclo[1.1.0]butane);1,1-dimethylcyclopropane;ethane;bis(1-methylbicyclo[1.1.0]butane)?
The InChIKey is SUUWOYNARSTATM-UHFFFAOYSA-N. The full InChI is InChI=1S/6C6H10.2C5H8.C5H10.11C3H6.3C2H6/c6*1-5-3-6(5,2)4-5;2*1-5-2-4(5)3-5;1-5(2)3-4-5;11*1-2-3-1;3*1-2/h6*3-4H2,1-2H3;2*4H,2-3H2,1H3;3-4H2,1-2H3;11*1-3H2;3*1-2H3.
What are the key properties of cyclopropane;hexakis(1,3-dimethylbicyclo[1.1.0]butane);1,1-dimethylcyclopropane;ethane;bis(1-methylbicyclo[1.1.0]butane)?
cyclopropane;hexakis(1,3-dimethylbicyclo[1.1.0]butane);1,1-dimethylcyclopropane;ethane;bis(1-methylbicyclo[1.1.0]butane) has a molecular weight of 1252.35 g/mol, XLogP of 31.43, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropane;hexakis(1,3-dimethylbicyclo[1.1.0]butane);1,1-dimethylcyclopropane;ethane;bis(1-methylbicyclo[1.1.0]butane) is sourced from PubChem (CID 160943515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).