1-methyl-4-(2-methylbutyl)-2-propan-2-ylcyclopentane

C14H28 — CID 123749319

IUPAC1-methyl-4-(2-methylbutyl)-2-propan-2-ylcyclopentane
SMILESCCC(C)CC1CC(C)C(C(C)C)C1
InChIInChI=1S/C14H28/c1-6-11(4)7-13-8-12(5)14(9-13)10(2)3/h10-14H,6-9H2,1-5H3
InChIKeyOGDUMQUCCFEFNB-UHFFFAOYSA-N
MW196.38 g/mol
LogP4.74
Rot. Bonds4

About 1-methyl-4-(2-methylbutyl)-2-propan-2-ylcyclopentane

1-methyl-4-(2-methylbutyl)-2-propan-2-ylcyclopentane (PubChem CID 123749319) has the molecular formula C14H28 and a molecular weight of 196.38 g/mol. Its IUPAC name is 1-methyl-4-(2-methylbutyl)-2-propan-2-ylcyclopentane.

Molecular Properties

Compound Name1-methyl-4-(2-methylbutyl)-2-propan-2-ylcyclopentane
PubChem CID123749319
Molecular FormulaC14H28
Molecular Weight196.38 g/mol
Exact Mass196.22
IUPAC Name1-methyl-4-(2-methylbutyl)-2-propan-2-ylcyclopentane
SMILESCCC(C)CC1CC(C)C(C(C)C)C1
InChIInChI=1S/C14H28/c1-6-11(4)7-13-8-12(5)14(9-13)10(2)3/h10-14H,6-9H2,1-5H3
InChIKeyOGDUMQUCCFEFNB-UHFFFAOYSA-N
XLogP4.74
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.38
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-methyl-2-(2-methylbutyl)cyclopropane
CID 91076617
azane;1-methyl-2-propan-2-ylcyclopropane
CID 21258764
ethane;1-methyl-2-propan-2-ylcyclopropane
CID 143332059
1,2-diethyl-4-methyl-5-propan-2-ylcyclohexane;ethane
CID 142876952
1,4-dimethyl-2-propan-2-ylcyclopentane
CID 91513076
ethane;[(2S)-2-methylbutyl]cyclopropane;molecular hydrogen
CID 145112018
1-ethyl-3-methyl-2-(2-methylbutyl)cyclobutane
CID 90801138
azane;2-methylbutylcyclohexane
CID 143986613
cis-(1S,2R)-1,2-dimethylcyclopropane;ethane;methane;trans-(1S,2R)-1-methyl-2-propan-2-ylcyclopropane
CID 158862378
ethane;1-ethyl-4-(2-methylbutyl)cyclohexane;propane
CID 144507767
[4-(2-methylbutyl)cyclohexyl]methanamine
CID 130208059
2,4-dimethyl-1-propan-2-ylcyclohexane;propane
CID 143365202

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(2-methylbutyl)-2-propan-2-ylcyclopentane?
The IUPAC name of 1-methyl-4-(2-methylbutyl)-2-propan-2-ylcyclopentane (CID 123749319) is 1-methyl-4-(2-methylbutyl)-2-propan-2-ylcyclopentane.
What is the SMILES notation for 1-methyl-4-(2-methylbutyl)-2-propan-2-ylcyclopentane?
The canonical SMILES for 1-methyl-4-(2-methylbutyl)-2-propan-2-ylcyclopentane is CCC(C)CC1CC(C)C(C(C)C)C1.
What is the InChIKey of 1-methyl-4-(2-methylbutyl)-2-propan-2-ylcyclopentane?
The InChIKey is OGDUMQUCCFEFNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28/c1-6-11(4)7-13-8-12(5)14(9-13)10(2)3/h10-14H,6-9H2,1-5H3.
What are the key properties of 1-methyl-4-(2-methylbutyl)-2-propan-2-ylcyclopentane?
1-methyl-4-(2-methylbutyl)-2-propan-2-ylcyclopentane has a molecular weight of 196.38 g/mol, XLogP of 4.74, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(2-methylbutyl)-2-propan-2-ylcyclopentane is sourced from PubChem (CID 123749319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).