cis-(1S,2R)-2-hydroxycyclopentane-1-carboxylic acid

C6H10O3 — CID 12924464

IUPACcis-(1S,2R)-2-hydroxycyclopentane-1-carboxylic acid
SMILESO=C(O)[C@H]1CCC[C@H]1O
InChIInChI=1S/C6H10O3/c7-5-3-1-2-4(5)6(8)9/h4-5,7H,1-3H2,(H,8,9)/t4-,5+/m0/s1
InChIKeyVCHGSWURBGPKQZ-CRCLSJGQSA-N
MW130.14 g/mol
LogP0.23
Rot. Bonds1

About cis-(1S,2R)-2-hydroxycyclopentane-1-carboxylic acid

cis-(1S,2R)-2-hydroxycyclopentane-1-carboxylic acid (PubChem CID 12924464) has the molecular formula C6H10O3 and a molecular weight of 130.14 g/mol. Its IUPAC name is cis-(1S,2R)-2-hydroxycyclopentane-1-carboxylic acid.

Molecular Properties

Compound Namecis-(1S,2R)-2-hydroxycyclopentane-1-carboxylic acid
PubChem CID12924464
Molecular FormulaC6H10O3
Molecular Weight130.14 g/mol
Exact Mass130.06
IUPAC Namecis-(1S,2R)-2-hydroxycyclopentane-1-carboxylic acid
SMILESO=C(O)[C@H]1CCC[C@H]1O
InChIInChI=1S/C6H10O3/c7-5-3-1-2-4(5)6(8)9/h4-5,7H,1-3H2,(H,8,9)/t4-,5+/m0/s1
InChIKeyVCHGSWURBGPKQZ-CRCLSJGQSA-N
XLogP0.23
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.14
LogP ≤ 50.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-Hydroxy-5-methylhexanoic acid
CID 193804
2-Hydroxycyclopentane-1-carboxylic acid
CID 552195
(3R)-3-hydroxy-5-methylhexanoic acid
CID 11105501
(1R,2R)-2-hydroxycyclopentane-1-carboxylic acid
CID 12924462
3-Hydroxy-4-methylhexanoic acid
CID 22471996
Ethyl 2-hydroxycyclopentanecarboxylate
CID 275611
rel-Ethyl (1R,2S)-2-hydroxycyclopentanecarboxylate
CID 2724648
2-Hydroxy-1-methylcyclopentane-1-carboxylic acid
CID 14382720
2-Methoxycyclopentane-1-carboxylic acid
CID 14711761
(1S,2S)-2-hydroxycyclopentane-1-carboxylic acid
CID 55299078
2-Ethyl-3-hydroxyhexanoic acid
CID 22157349
cis-2-Hydroxy-cyclopentanecarboxylic acid ethyl ester
CID 10511136

Frequently Asked Questions

What is the IUPAC name of cis-(1S,2R)-2-hydroxycyclopentane-1-carboxylic acid?
The IUPAC name of cis-(1S,2R)-2-hydroxycyclopentane-1-carboxylic acid (CID 12924464) is cis-(1S,2R)-2-hydroxycyclopentane-1-carboxylic acid.
What is the SMILES notation for cis-(1S,2R)-2-hydroxycyclopentane-1-carboxylic acid?
The canonical SMILES for cis-(1S,2R)-2-hydroxycyclopentane-1-carboxylic acid is O=C(O)[C@H]1CCC[C@H]1O.
What is the InChIKey of cis-(1S,2R)-2-hydroxycyclopentane-1-carboxylic acid?
The InChIKey is VCHGSWURBGPKQZ-CRCLSJGQSA-N. The full InChI is InChI=1S/C6H10O3/c7-5-3-1-2-4(5)6(8)9/h4-5,7H,1-3H2,(H,8,9)/t4-,5+/m0/s1.
What are the key properties of cis-(1S,2R)-2-hydroxycyclopentane-1-carboxylic acid?
cis-(1S,2R)-2-hydroxycyclopentane-1-carboxylic acid has a molecular weight of 130.14 g/mol, XLogP of 0.23, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1S,2R)-2-hydroxycyclopentane-1-carboxylic acid is sourced from PubChem (CID 12924464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).