1,3-diethyl-1-(2-methylbutyl)cyclopentane

C14H28 — CID 123267879

IUPAC1,3-diethyl-1-(2-methylbutyl)cyclopentane
SMILESCCC(C)CC1(CC)CCC(CC)C1
InChIInChI=1S/C14H28/c1-5-12(4)10-14(7-3)9-8-13(6-2)11-14/h12-13H,5-11H2,1-4H3
InChIKeyPHQQXWOPZAOUKB-UHFFFAOYSA-N
MW196.38 g/mol
LogP5.03
Rot. Bonds5

About 1,3-diethyl-1-(2-methylbutyl)cyclopentane

1,3-diethyl-1-(2-methylbutyl)cyclopentane (PubChem CID 123267879) has the molecular formula C14H28 and a molecular weight of 196.38 g/mol. Its IUPAC name is 1,3-diethyl-1-(2-methylbutyl)cyclopentane.

Molecular Properties

Compound Name1,3-diethyl-1-(2-methylbutyl)cyclopentane
PubChem CID123267879
Molecular FormulaC14H28
Molecular Weight196.38 g/mol
Exact Mass196.22
IUPAC Name1,3-diethyl-1-(2-methylbutyl)cyclopentane
SMILESCCC(C)CC1(CC)CCC(CC)C1
InChIInChI=1S/C14H28/c1-5-12(4)10-14(7-3)9-8-13(6-2)11-14/h12-13H,5-11H2,1-4H3
InChIKeyPHQQXWOPZAOUKB-UHFFFAOYSA-N
XLogP5.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500196.38
LogP ≤ 55.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-butyl-1,3-diethylcyclopentane
CID 144986630
4-ethyl-1-(2-methylbutyl)cyclohexan-1-ol
CID 65147481
[3-ethyl-1-(2-methylpentyl)cyclohexyl]methanamine
CID 65401872
1-(2-methylbutyl)-4-propylcyclohexan-1-amine
CID 63407800
1-ethyl-3-methyl-1-(2-methylpropyl)cyclopentane
CID 123256841
3-ethyl-1-methyl-1-propan-2-ylcyclopentane
CID 91433980
3-ethyl-3-(2-methylbutyl)pyrrolidine
CID 62352988
1-[1-(aminomethyl)-3-ethylcyclopentyl]-4-propan-2-ylcyclohexan-1-ol
CID 79135033
3-methyl-3-(2-methylbutyl)cyclopentan-1-amine
CID 116538708
3-methyl-1-(2-methylbutyl)cyclopentan-1-amine
CID 64515762
1,3-diethyl-3-(2-methylbutyl)azetidine
CID 166548654
1,3-diethyl-1-propylcyclohexadecane
CID 123944709

Frequently Asked Questions

What is the IUPAC name of 1,3-diethyl-1-(2-methylbutyl)cyclopentane?
The IUPAC name of 1,3-diethyl-1-(2-methylbutyl)cyclopentane (CID 123267879) is 1,3-diethyl-1-(2-methylbutyl)cyclopentane.
What is the SMILES notation for 1,3-diethyl-1-(2-methylbutyl)cyclopentane?
The canonical SMILES for 1,3-diethyl-1-(2-methylbutyl)cyclopentane is CCC(C)CC1(CC)CCC(CC)C1.
What is the InChIKey of 1,3-diethyl-1-(2-methylbutyl)cyclopentane?
The InChIKey is PHQQXWOPZAOUKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28/c1-5-12(4)10-14(7-3)9-8-13(6-2)11-14/h12-13H,5-11H2,1-4H3.
What are the key properties of 1,3-diethyl-1-(2-methylbutyl)cyclopentane?
1,3-diethyl-1-(2-methylbutyl)cyclopentane has a molecular weight of 196.38 g/mol, XLogP of 5.03, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-diethyl-1-(2-methylbutyl)cyclopentane is sourced from PubChem (CID 123267879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).