ethane;1,1,2,3,3-pentamethylcyclobutane

C11H24 — CID 177318359

IUPACethane;1,1,2,3,3-pentamethylcyclobutane
SMILESCC.CC1C(C)(C)CC1(C)C
InChIInChI=1S/C9H18.C2H6/c1-7-8(2,3)6-9(7,4)5;1-2/h7H,6H2,1-5H3;1-2H3
InChIKeySESMDYSTLURKEG-UHFFFAOYSA-N
MW156.31 g/mol
LogP4.10
Rot. Bonds

About ethane;1,1,2,3,3-pentamethylcyclobutane

ethane;1,1,2,3,3-pentamethylcyclobutane (PubChem CID 177318359) has the molecular formula C11H24 and a molecular weight of 156.31 g/mol. Its IUPAC name is ethane;1,1,2,3,3-pentamethylcyclobutane.

Molecular Properties

Compound Nameethane;1,1,2,3,3-pentamethylcyclobutane
PubChem CID177318359
Molecular FormulaC11H24
Molecular Weight156.31 g/mol
Exact Mass156.19
IUPAC Nameethane;1,1,2,3,3-pentamethylcyclobutane
SMILESCC.CC1C(C)(C)CC1(C)C
InChIInChI=1S/C9H18.C2H6/c1-7-8(2,3)6-9(7,4)5;1-2/h7H,6H2,1-5H3;1-2H3
InChIKeySESMDYSTLURKEG-UHFFFAOYSA-N
XLogP4.10
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.31
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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1,1,3,3-tetramethyl-2-propan-2-ylcyclobutane
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trans-(1R,2R)-3,3,5,5-tetramethylcyclopentane-1,2-diol
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(2S)-1,1,2-trimethylcyclopropane
CID 25022262
1,1,2,3,3-pentamethyl-5-propan-2-ylcyclohexane
CID 140583880
2-methoxy-1,1,3,3-tetramethylcyclobutane
CID 163267922
(2R)-1-fluoro-1,2-dimethylcyclopropane
CID 147738297
azane;1,1,2-trimethylcyclopropane;hydrochloride
CID 174915163
(4S)-4-tert-butyl-1,1,2,2,3,4-hexamethylcyclopentane;ethane
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Frequently Asked Questions

What is the IUPAC name of ethane;1,1,2,3,3-pentamethylcyclobutane?
The IUPAC name of ethane;1,1,2,3,3-pentamethylcyclobutane (CID 177318359) is ethane;1,1,2,3,3-pentamethylcyclobutane.
What is the SMILES notation for ethane;1,1,2,3,3-pentamethylcyclobutane?
The canonical SMILES for ethane;1,1,2,3,3-pentamethylcyclobutane is CC.CC1C(C)(C)CC1(C)C.
What is the InChIKey of ethane;1,1,2,3,3-pentamethylcyclobutane?
The InChIKey is SESMDYSTLURKEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18.C2H6/c1-7-8(2,3)6-9(7,4)5;1-2/h7H,6H2,1-5H3;1-2H3.
What are the key properties of ethane;1,1,2,3,3-pentamethylcyclobutane?
ethane;1,1,2,3,3-pentamethylcyclobutane has a molecular weight of 156.31 g/mol, XLogP of 4.10, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1,1,2,3,3-pentamethylcyclobutane is sourced from PubChem (CID 177318359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).