1,1-dimethylcyclobutane;1,1-dimethylcyclopentane;1,1-dimethylcyclopropane

C18H36 — CID 158949227

IUPAC1,1-dimethylcyclobutane;1,1-dimethylcyclopentane;1,1-dimethylcyclopropane
SMILESCC1(C)CC1.CC1(C)CCC1.CC1(C)CCCC1
InChIInChI=1S/C7H14.C6H12.C5H10/c1-7(2)5-3-4-6-7;1-6(2)4-3-5-6;1-5(2)3-4-5/h3-6H2,1-2H3;3-5H2,1-2H3;3-4H2,1-2H3
InChIKeyJLFFBXQQLPNJMP-UHFFFAOYSA-N
MW252.49 g/mol
LogP6.59
Rot. Bonds

About 1,1-dimethylcyclobutane;1,1-dimethylcyclopentane;1,1-dimethylcyclopropane

1,1-dimethylcyclobutane;1,1-dimethylcyclopentane;1,1-dimethylcyclopropane (PubChem CID 158949227) has the molecular formula C18H36 and a molecular weight of 252.49 g/mol. Its IUPAC name is 1,1-dimethylcyclobutane;1,1-dimethylcyclopentane;1,1-dimethylcyclopropane.

Molecular Properties

Compound Name1,1-dimethylcyclobutane;1,1-dimethylcyclopentane;1,1-dimethylcyclopropane
PubChem CID158949227
Molecular FormulaC18H36
Molecular Weight252.49 g/mol
Exact Mass252.28
IUPAC Name1,1-dimethylcyclobutane;1,1-dimethylcyclopentane;1,1-dimethylcyclopropane
SMILESCC1(C)CC1.CC1(C)CCC1.CC1(C)CCCC1
InChIInChI=1S/C7H14.C6H12.C5H10/c1-7(2)5-3-4-6-7;1-6(2)4-3-5-6;1-5(2)3-4-5/h3-6H2,1-2H3;3-5H2,1-2H3;3-4H2,1-2H3
InChIKeyJLFFBXQQLPNJMP-UHFFFAOYSA-N
XLogP6.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500252.49
LogP ≤ 56.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,1-dimethylcyclopentane;zinc
CID 174960258
1,1,7,7-tetramethylcyclopentadecane
CID 123360096
1,1-dimethylcyclononane
CID 59289773
1,1-dimethylcyclohexane;methane
CID 160770296
azane;1,1-dimethylcyclohexane
CID 90411117
1,1-dimethylcyclobutane;vanadium
CID 158712416
carbanide;cyclopentane;1,1-dimethylcyclohexane;zirconium(2+)
CID 162284828
1-chloro-1,5,5-trimethylcyclotridecane
CID 71162180
1,1-dimethylcyclobutane;1,1-dimethylcyclohexane;1,1-dimethylcyclopentane;1,1-dimethylcyclopropane;1,1,2-trimethylcyclopropane
CID 158329208
1,1,2,2,5,5-hexamethylcyclononane
CID 123180504
6,6-dimethyldispiro[4.1.47.35]tetradecane
CID 123325796
1,6,6-trimethylazecane
CID 137411495

Frequently Asked Questions

What is the IUPAC name of 1,1-dimethylcyclobutane;1,1-dimethylcyclopentane;1,1-dimethylcyclopropane?
The IUPAC name of 1,1-dimethylcyclobutane;1,1-dimethylcyclopentane;1,1-dimethylcyclopropane (CID 158949227) is 1,1-dimethylcyclobutane;1,1-dimethylcyclopentane;1,1-dimethylcyclopropane.
What is the SMILES notation for 1,1-dimethylcyclobutane;1,1-dimethylcyclopentane;1,1-dimethylcyclopropane?
The canonical SMILES for 1,1-dimethylcyclobutane;1,1-dimethylcyclopentane;1,1-dimethylcyclopropane is CC1(C)CC1.CC1(C)CCC1.CC1(C)CCCC1.
What is the InChIKey of 1,1-dimethylcyclobutane;1,1-dimethylcyclopentane;1,1-dimethylcyclopropane?
The InChIKey is JLFFBXQQLPNJMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14.C6H12.C5H10/c1-7(2)5-3-4-6-7;1-6(2)4-3-5-6;1-5(2)3-4-5/h3-6H2,1-2H3;3-5H2,1-2H3;3-4H2,1-2H3.
What are the key properties of 1,1-dimethylcyclobutane;1,1-dimethylcyclopentane;1,1-dimethylcyclopropane?
1,1-dimethylcyclobutane;1,1-dimethylcyclopentane;1,1-dimethylcyclopropane has a molecular weight of 252.49 g/mol, XLogP of 6.59, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dimethylcyclobutane;1,1-dimethylcyclopentane;1,1-dimethylcyclopropane is sourced from PubChem (CID 158949227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).