cis-(1S,2R)-1-ethyl-4-methyl-2-(3-methylbutyl)cyclopentane

C13H26 — CID 143682309

IUPACcis-(1S,2R)-1-ethyl-4-methyl-2-(3-methylbutyl)cyclopentane
SMILESCC[C@H]1CC(C)C[C@H]1CCC(C)C
InChIInChI=1S/C13H26/c1-5-12-8-11(4)9-13(12)7-6-10(2)3/h10-13H,5-9H2,1-4H3/t11?,12-,13+/m0/s1
InChIKeyUKOVNNBZJAFADY-LWNNLKQOSA-N
MW182.35 g/mol
LogP4.49
Rot. Bonds4

About cis-(1S,2R)-1-ethyl-4-methyl-2-(3-methylbutyl)cyclopentane

cis-(1S,2R)-1-ethyl-4-methyl-2-(3-methylbutyl)cyclopentane (PubChem CID 143682309) has the molecular formula C13H26 and a molecular weight of 182.35 g/mol. Its IUPAC name is cis-(1S,2R)-1-ethyl-4-methyl-2-(3-methylbutyl)cyclopentane.

Molecular Properties

Compound Namecis-(1S,2R)-1-ethyl-4-methyl-2-(3-methylbutyl)cyclopentane
PubChem CID143682309
Molecular FormulaC13H26
Molecular Weight182.35 g/mol
Exact Mass182.20
IUPAC Namecis-(1S,2R)-1-ethyl-4-methyl-2-(3-methylbutyl)cyclopentane
SMILESCC[C@H]1CC(C)C[C@H]1CCC(C)C
InChIInChI=1S/C13H26/c1-5-12-8-11(4)9-13(12)7-6-10(2)3/h10-13H,5-9H2,1-4H3/t11?,12-,13+/m0/s1
InChIKeyUKOVNNBZJAFADY-LWNNLKQOSA-N
XLogP4.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.35
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-ethyl-2-(5-methylhexyl)cyclopropane
CID 123182568
1-(3,4-dimethylpentyl)-2-ethylcyclopropane
CID 123908789
1-(3,4-dimethylheptyl)-2-ethylcyclopropane
CID 123989323
1-ethyl-2-[2-(2-ethylcyclopropyl)ethyl]cyclobutane;1,5,9,12,16,20,23,27,31-nonamethyl-3,7,14,18,25,29-hexakis(2-methylpropyl)cyclotritriacontane
CID 91210730
4-ethyl-2-methyl-1-(3-methylbutyl)cyclohexane
CID 143714576
1-(3-cyclopropylbutyl)-2-ethylcyclopropane
CID 123702350
4-methyl-2-(3-methylbutyl)-N-propylcyclohexan-1-amine
CID 63403394
N-[[4-methyl-2-(3-methylbutyl)cyclohexyl]methyl]cyclopropanamine
CID 81032509
1-ethyl-2-[2-(2-methylcyclopropyl)ethyl]cyclopropane
CID 123992340
cis-(1S,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane
CID 173447814
trans-(1R,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane
CID 168764244
(4S)-2-ethyl-4-methylcyclopentan-1-amine
CID 163423682

Frequently Asked Questions

What is the IUPAC name of cis-(1S,2R)-1-ethyl-4-methyl-2-(3-methylbutyl)cyclopentane?
The IUPAC name of cis-(1S,2R)-1-ethyl-4-methyl-2-(3-methylbutyl)cyclopentane (CID 143682309) is cis-(1S,2R)-1-ethyl-4-methyl-2-(3-methylbutyl)cyclopentane.
What is the SMILES notation for cis-(1S,2R)-1-ethyl-4-methyl-2-(3-methylbutyl)cyclopentane?
The canonical SMILES for cis-(1S,2R)-1-ethyl-4-methyl-2-(3-methylbutyl)cyclopentane is CC[C@H]1CC(C)C[C@H]1CCC(C)C.
What is the InChIKey of cis-(1S,2R)-1-ethyl-4-methyl-2-(3-methylbutyl)cyclopentane?
The InChIKey is UKOVNNBZJAFADY-LWNNLKQOSA-N. The full InChI is InChI=1S/C13H26/c1-5-12-8-11(4)9-13(12)7-6-10(2)3/h10-13H,5-9H2,1-4H3/t11?,12-,13+/m0/s1.
What are the key properties of cis-(1S,2R)-1-ethyl-4-methyl-2-(3-methylbutyl)cyclopentane?
cis-(1S,2R)-1-ethyl-4-methyl-2-(3-methylbutyl)cyclopentane has a molecular weight of 182.35 g/mol, XLogP of 4.49, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1S,2R)-1-ethyl-4-methyl-2-(3-methylbutyl)cyclopentane is sourced from PubChem (CID 143682309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).