(3,5-dimethylthiophen-2-yl)-(1-ethylcyclopentyl)methanol

C14H22OS — CID 81158901

IUPAC(3,5-dimethylthiophen-2-yl)-(1-ethylcyclopentyl)methanol
SMILESCCC1(C(O)c2sc(C)cc2C)CCCC1
InChIInChI=1S/C14H22OS/c1-4-14(7-5-6-8-14)13(15)12-10(2)9-11(3)16-12/h9,13,15H,4-8H2,1-3H3
InChIKeyKHBMAXOKSSCKCA-UHFFFAOYSA-N
MW238.40 g/mol
LogP4.37
Rot. Bonds3

About (3,5-dimethylthiophen-2-yl)-(1-ethylcyclopentyl)methanol

(3,5-dimethylthiophen-2-yl)-(1-ethylcyclopentyl)methanol (PubChem CID 81158901) has the molecular formula C14H22OS and a molecular weight of 238.40 g/mol. Its IUPAC name is (3,5-dimethylthiophen-2-yl)-(1-ethylcyclopentyl)methanol.

Molecular Properties

Compound Name(3,5-dimethylthiophen-2-yl)-(1-ethylcyclopentyl)methanol
PubChem CID81158901
Molecular FormulaC14H22OS
Molecular Weight238.40 g/mol
Exact Mass238.14
IUPAC Name(3,5-dimethylthiophen-2-yl)-(1-ethylcyclopentyl)methanol
SMILESCCC1(C(O)c2sc(C)cc2C)CCCC1
InChIInChI=1S/C14H22OS/c1-4-14(7-5-6-8-14)13(15)12-10(2)9-11(3)16-12/h9,13,15H,4-8H2,1-3H3
InChIKeyKHBMAXOKSSCKCA-UHFFFAOYSA-N
XLogP4.37
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.40
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,5-dimethylthiophen-2-yl)propan-1-ol
CID 81157083
1-(3,5-dimethylthiophen-2-yl)-3-methylpentan-1-ol
CID 114875969
N-[(3,5-dimethylthiophen-2-yl)-(2-methyloxolan-2-yl)methyl]ethanamine
CID 81156806
N-[(2,2-dimethylcyclopentyl)-(3,5-dimethylthiophen-2-yl)methyl]ethanamine
CID 107178071
(1-ethylcyclopentyl)-(2-methoxypyrimidin-5-yl)methanol
CID 112747712
(4-bromo-5-chlorothiophen-2-yl)-(1-ethylcyclopropyl)methanol
CID 130553458
(3,5-dimethylthiophen-2-yl)-(oxolan-3-yl)methanol
CID 81157613
2-[1-chloro-2-(3-ethoxycyclobutyl)ethyl]-3,5-dimethylthiophene
CID 103165987
1-benzothiophen-7-yl-(1-ethylcyclopentyl)methanol
CID 115827254
N-[(2,2-dimethylcyclopentyl)-(3,5-dimethylthiophen-2-yl)methyl]propan-1-amine
CID 107178074
2-(1-chloro-2,2-dimethylpropyl)-3,5-dimethylthiophene
CID 81157902
N-[cyclohexyl-(3,5-dimethylthiophen-2-yl)methyl]ethanamine
CID 81157381

Frequently Asked Questions

What is the IUPAC name of (3,5-dimethylthiophen-2-yl)-(1-ethylcyclopentyl)methanol?
The IUPAC name of (3,5-dimethylthiophen-2-yl)-(1-ethylcyclopentyl)methanol (CID 81158901) is (3,5-dimethylthiophen-2-yl)-(1-ethylcyclopentyl)methanol.
What is the SMILES notation for (3,5-dimethylthiophen-2-yl)-(1-ethylcyclopentyl)methanol?
The canonical SMILES for (3,5-dimethylthiophen-2-yl)-(1-ethylcyclopentyl)methanol is CCC1(C(O)c2sc(C)cc2C)CCCC1.
What is the InChIKey of (3,5-dimethylthiophen-2-yl)-(1-ethylcyclopentyl)methanol?
The InChIKey is KHBMAXOKSSCKCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22OS/c1-4-14(7-5-6-8-14)13(15)12-10(2)9-11(3)16-12/h9,13,15H,4-8H2,1-3H3.
What are the key properties of (3,5-dimethylthiophen-2-yl)-(1-ethylcyclopentyl)methanol?
(3,5-dimethylthiophen-2-yl)-(1-ethylcyclopentyl)methanol has a molecular weight of 238.40 g/mol, XLogP of 4.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethylthiophen-2-yl)-(1-ethylcyclopentyl)methanol is sourced from PubChem (CID 81158901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).