cis-(1R,2S)-1-methyl-2-[(2R)-3-methylbutan-2-yl]cyclopentane

C11H22 — CID 163236440

IUPACcis-(1R,2S)-1-methyl-2-[(2R)-3-methylbutan-2-yl]cyclopentane
SMILESCC(C)[C@@H](C)[C@H]1CCC[C@H]1C
InChIInChI=1S/C11H22/c1-8(2)10(4)11-7-5-6-9(11)3/h8-11H,5-7H2,1-4H3/t9-,10-,11+/m1/s1
InChIKeyOCBUCLRUNIEGNG-MXWKQRLJSA-N
MW154.30 g/mol
LogP3.71
Rot. Bonds2

About cis-(1R,2S)-1-methyl-2-[(2R)-3-methylbutan-2-yl]cyclopentane

cis-(1R,2S)-1-methyl-2-[(2R)-3-methylbutan-2-yl]cyclopentane (PubChem CID 163236440) has the molecular formula C11H22 and a molecular weight of 154.30 g/mol. Its IUPAC name is cis-(1R,2S)-1-methyl-2-[(2R)-3-methylbutan-2-yl]cyclopentane.

Molecular Properties

Compound Namecis-(1R,2S)-1-methyl-2-[(2R)-3-methylbutan-2-yl]cyclopentane
PubChem CID163236440
Molecular FormulaC11H22
Molecular Weight154.30 g/mol
Exact Mass154.17
IUPAC Namecis-(1R,2S)-1-methyl-2-[(2R)-3-methylbutan-2-yl]cyclopentane
SMILESCC(C)[C@@H](C)[C@H]1CCC[C@H]1C
InChIInChI=1S/C11H22/c1-8(2)10(4)11-7-5-6-9(11)3/h8-11H,5-7H2,1-4H3/t9-,10-,11+/m1/s1
InChIKeyOCBUCLRUNIEGNG-MXWKQRLJSA-N
XLogP3.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.30
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

4,5-Dimethylnonane
CID 86541
(1alpha,2alpha,4beta)-1,2,4-Trimethylcyclopentane
CID 17779
1,2,3-Trimethylcyclopentane
CID 35368
2-Ethyl-1,1-dimethylcyclopentane
CID 41123
Isobutylcyclopentane
CID 77414
(1R,2S)-1-heptyl-2-octylcyclopentane
CID 107873
Propylcyclopentane
CID 16270
Octane, 2,3,7-trimethyl-
CID 43867
3,4-Dimethyloctane
CID 85926
Pentylcyclopentane
CID 19540
Decylcyclopentane
CID 137211
Cyclopentane, 1-butyl-2-propyl-
CID 112469

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2S)-1-methyl-2-[(2R)-3-methylbutan-2-yl]cyclopentane?
The IUPAC name of cis-(1R,2S)-1-methyl-2-[(2R)-3-methylbutan-2-yl]cyclopentane (CID 163236440) is cis-(1R,2S)-1-methyl-2-[(2R)-3-methylbutan-2-yl]cyclopentane.
What is the SMILES notation for cis-(1R,2S)-1-methyl-2-[(2R)-3-methylbutan-2-yl]cyclopentane?
The canonical SMILES for cis-(1R,2S)-1-methyl-2-[(2R)-3-methylbutan-2-yl]cyclopentane is CC(C)[C@@H](C)[C@H]1CCC[C@H]1C.
What is the InChIKey of cis-(1R,2S)-1-methyl-2-[(2R)-3-methylbutan-2-yl]cyclopentane?
The InChIKey is OCBUCLRUNIEGNG-MXWKQRLJSA-N. The full InChI is InChI=1S/C11H22/c1-8(2)10(4)11-7-5-6-9(11)3/h8-11H,5-7H2,1-4H3/t9-,10-,11+/m1/s1.
What are the key properties of cis-(1R,2S)-1-methyl-2-[(2R)-3-methylbutan-2-yl]cyclopentane?
cis-(1R,2S)-1-methyl-2-[(2R)-3-methylbutan-2-yl]cyclopentane has a molecular weight of 154.30 g/mol, XLogP of 3.71, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-1-methyl-2-[(2R)-3-methylbutan-2-yl]cyclopentane is sourced from PubChem (CID 163236440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).