(2S)-3-(5-ethylthiophen-2-yl)-2-methylpropan-1-ol

C10H16OS — CID 15156703

IUPAC(2S)-3-(5-ethylthiophen-2-yl)-2-methylpropan-1-ol
SMILESCCc1ccc(C[C@H](C)CO)s1
InChIInChI=1S/C10H16OS/c1-3-9-4-5-10(12-9)6-8(2)7-11/h4-5,8,11H,3,6-7H2,1-2H3/t8-/m0/s1
InChIKeyFUGFAJKTSZUXCX-QMMMGPOBSA-N
MW184.30 g/mol
LogP2.48
Rot. Bonds4

About (2S)-3-(5-ethylthiophen-2-yl)-2-methylpropan-1-ol

(2S)-3-(5-ethylthiophen-2-yl)-2-methylpropan-1-ol (PubChem CID 15156703) has the molecular formula C10H16OS and a molecular weight of 184.30 g/mol. Its IUPAC name is (2S)-3-(5-ethylthiophen-2-yl)-2-methylpropan-1-ol.

Molecular Properties

Compound Name(2S)-3-(5-ethylthiophen-2-yl)-2-methylpropan-1-ol
PubChem CID15156703
Molecular FormulaC10H16OS
Molecular Weight184.30 g/mol
Exact Mass184.09
IUPAC Name(2S)-3-(5-ethylthiophen-2-yl)-2-methylpropan-1-ol
SMILESCCc1ccc(C[C@H](C)CO)s1
InChIInChI=1S/C10H16OS/c1-3-9-4-5-10(12-9)6-8(2)7-11/h4-5,8,11H,3,6-7H2,1-2H3/t8-/m0/s1
InChIKeyFUGFAJKTSZUXCX-QMMMGPOBSA-N
XLogP2.48
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.30
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(Thiophen-2-yl)propan-1-ol
CID 13109866
2-(5-Methylthiophen-2-yl)ethan-1-ol
CID 13289289
2-(2-Thienyl)cyclohexanol
CID 2760612
2-(2,5-Dimethylthiophen-3-yl)ethan-1-ol
CID 13144702
3-Hydroxy-2-(thiophen-2-ylmethyl)propanenitrile
CID 55163473
rac-[(1R,2R)-2-(thiophen-2-yl)cyclopropyl]methanol
CID 67942345
4-(Thiophen-2-yl)butan-1-ol
CID 12623862
[(1R,2R)-2-(5-Bromothiophen-2-yl)cyclopropyl]methanol
CID 155821129
3-Methyl-5-(2-thienyl)pentanol
CID 23272364
2-Thiophenepentanol
CID 12197744
6-(2-Thienyl)hexanol
CID 12197745
6-(Thiophen-3-yl)hexan-1-ol
CID 13557546

Frequently Asked Questions

What is the IUPAC name of (2S)-3-(5-ethylthiophen-2-yl)-2-methylpropan-1-ol?
The IUPAC name of (2S)-3-(5-ethylthiophen-2-yl)-2-methylpropan-1-ol (CID 15156703) is (2S)-3-(5-ethylthiophen-2-yl)-2-methylpropan-1-ol.
What is the SMILES notation for (2S)-3-(5-ethylthiophen-2-yl)-2-methylpropan-1-ol?
The canonical SMILES for (2S)-3-(5-ethylthiophen-2-yl)-2-methylpropan-1-ol is CCc1ccc(C[C@H](C)CO)s1.
What is the InChIKey of (2S)-3-(5-ethylthiophen-2-yl)-2-methylpropan-1-ol?
The InChIKey is FUGFAJKTSZUXCX-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H16OS/c1-3-9-4-5-10(12-9)6-8(2)7-11/h4-5,8,11H,3,6-7H2,1-2H3/t8-/m0/s1.
What are the key properties of (2S)-3-(5-ethylthiophen-2-yl)-2-methylpropan-1-ol?
(2S)-3-(5-ethylthiophen-2-yl)-2-methylpropan-1-ol has a molecular weight of 184.30 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-3-(5-ethylthiophen-2-yl)-2-methylpropan-1-ol is sourced from PubChem (CID 15156703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).