(2S)-2-ethylcyclopentane-1-carboxylic acid

C8H14O2 — CID 59114270

IUPAC(2S)-2-ethylcyclopentane-1-carboxylic acid
SMILESCC[C@H]1CCCC1C(=O)O
InChIInChI=1S/C8H14O2/c1-2-6-4-3-5-7(6)8(9)10/h6-7H,2-5H2,1H3,(H,9,10)/t6-,7?/m0/s1
InChIKeyGOKBOUQBQXABPQ-PKPIPKONSA-N
MW142.20 g/mol
LogP1.90
Rot. Bonds2

About (2S)-2-ethylcyclopentane-1-carboxylic acid

(2S)-2-ethylcyclopentane-1-carboxylic acid (PubChem CID 59114270) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is (2S)-2-ethylcyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name(2S)-2-ethylcyclopentane-1-carboxylic acid
PubChem CID59114270
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name(2S)-2-ethylcyclopentane-1-carboxylic acid
SMILESCC[C@H]1CCCC1C(=O)O
InChIInChI=1S/C8H14O2/c1-2-6-4-3-5-7(6)8(9)10/h6-7H,2-5H2,1H3,(H,9,10)/t6-,7?/m0/s1
InChIKeyGOKBOUQBQXABPQ-PKPIPKONSA-N
XLogP1.90
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

trans-(1R,2S)-2-(fluoromethyl)cyclopentane-1-carboxylic acid
CID 96581659
carbonic acid;1,2-diethylcyclohexane
CID 70579518
5-ethyl-1-methylazepane-4-carboxylic acid
CID 84769802
cis-ethyl (1R,2R)-2-ethylcyclopentane-1-carboxylate
CID 101471525
cis-(1S,2S)-2-(fluoromethyl)cyclohexane-1-carboxylic acid
CID 96581669
2-(cyclohexylmethyl)cyclopentane-1-carboxylic acid
CID 81008981
trans-(1S,2R)-2-[(dimethylamino)methyl]cyclohexane-1-carboxylic acid
CID 145395448
2-prop-2-ynylcyclopentane-1-carboxylic acid
CID 81009322
1-(2-ethylcyclohexyl)-2-methylprop-2-en-1-one
CID 58325604
trans-(1R,2S)-2-(formamidomethyl)cyclopentane-1-carboxylic acid
CID 130649468
2-(2-ethylhexyl)cyclopentane-1-carboxylic acid
CID 81008544
2-[(3-propylazetidin-1-yl)methyl]cyclohexane-1-carboxylic acid
CID 79688129

Frequently Asked Questions

What is the IUPAC name of (2S)-2-ethylcyclopentane-1-carboxylic acid?
The IUPAC name of (2S)-2-ethylcyclopentane-1-carboxylic acid (CID 59114270) is (2S)-2-ethylcyclopentane-1-carboxylic acid.
What is the SMILES notation for (2S)-2-ethylcyclopentane-1-carboxylic acid?
The canonical SMILES for (2S)-2-ethylcyclopentane-1-carboxylic acid is CC[C@H]1CCCC1C(=O)O.
What is the InChIKey of (2S)-2-ethylcyclopentane-1-carboxylic acid?
The InChIKey is GOKBOUQBQXABPQ-PKPIPKONSA-N. The full InChI is InChI=1S/C8H14O2/c1-2-6-4-3-5-7(6)8(9)10/h6-7H,2-5H2,1H3,(H,9,10)/t6-,7?/m0/s1.
What are the key properties of (2S)-2-ethylcyclopentane-1-carboxylic acid?
(2S)-2-ethylcyclopentane-1-carboxylic acid has a molecular weight of 142.20 g/mol, XLogP of 1.90, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-ethylcyclopentane-1-carboxylic acid is sourced from PubChem (CID 59114270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).