oxolan-2-yl(thiophen-2-yl)methanol

C9H12O2S — CID 61087499

IUPACoxolan-2-yl(thiophen-2-yl)methanol
SMILESOC(c1cccs1)C1CCCO1
InChIInChI=1S/C9H12O2S/c10-9(7-3-1-5-11-7)8-4-2-6-12-8/h2,4,6-7,9-10H,1,3,5H2
InChIKeyYXNVVNCIKKJRNH-UHFFFAOYSA-N
MW184.26 g/mol
LogP1.96
Rot. Bonds2

About oxolan-2-yl(thiophen-2-yl)methanol

oxolan-2-yl(thiophen-2-yl)methanol (PubChem CID 61087499) has the molecular formula C9H12O2S and a molecular weight of 184.26 g/mol. Its IUPAC name is oxolan-2-yl(thiophen-2-yl)methanol.

Molecular Properties

Compound Nameoxolan-2-yl(thiophen-2-yl)methanol
PubChem CID61087499
Molecular FormulaC9H12O2S
Molecular Weight184.26 g/mol
Exact Mass184.06
IUPAC Nameoxolan-2-yl(thiophen-2-yl)methanol
SMILESOC(c1cccs1)C1CCCO1
InChIInChI=1S/C9H12O2S/c10-9(7-3-1-5-11-7)8-4-2-6-12-8/h2,4,6-7,9-10H,1,3,5H2
InChIKeyYXNVVNCIKKJRNH-UHFFFAOYSA-N
XLogP1.96
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.26
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

cyclopentyl(thiophen-2-yl)methanol
CID 43753540
(S)-oxan-4-yl(thiophen-2-yl)methanol
CID 129368530
oxolan-2-yl(thiophen-3-yl)methanol
CID 65331077
N-(dithiophen-2-ylmethyl)-2-(oxolan-2-yl)acetamide
CID 56793867
(1R)-N-(oxolan-2-ylmethyl)-1-thiophen-2-ylethanamine
CID 81408382
[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-thiophen-2-ylmethanol
CID 68902963
2-[1-(oxolan-2-ylmethyl)pyrrolidin-2-yl]-1-thiophen-2-ylethanol
CID 111858466
(5-methylfuran-2-yl)-(oxolan-2-yl)methanol
CID 123810880
(3R)-3-acetamido-N-[(1S)-1-[(2R)-oxolan-2-yl]ethyl]-3-thiophen-2-ylpropanamide
CID 124839099
2-[2-(oxan-2-yl)ethylamino]-1-thiophen-2-ylethanol
CID 114135927
1-[(2S)-2-(dimethylamino)-2-thiophen-2-ylethyl]-3-[(1S)-1-[(2S)-oxolan-2-yl]ethyl]urea
CID 95134541
(R)-[(1S)-cyclohex-2-en-1-yl]-thiophen-2-ylmethanol
CID 24809226

Frequently Asked Questions

What is the IUPAC name of oxolan-2-yl(thiophen-2-yl)methanol?
The IUPAC name of oxolan-2-yl(thiophen-2-yl)methanol (CID 61087499) is oxolan-2-yl(thiophen-2-yl)methanol.
What is the SMILES notation for oxolan-2-yl(thiophen-2-yl)methanol?
The canonical SMILES for oxolan-2-yl(thiophen-2-yl)methanol is OC(c1cccs1)C1CCCO1.
What is the InChIKey of oxolan-2-yl(thiophen-2-yl)methanol?
The InChIKey is YXNVVNCIKKJRNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12O2S/c10-9(7-3-1-5-11-7)8-4-2-6-12-8/h2,4,6-7,9-10H,1,3,5H2.
What are the key properties of oxolan-2-yl(thiophen-2-yl)methanol?
oxolan-2-yl(thiophen-2-yl)methanol has a molecular weight of 184.26 g/mol, XLogP of 1.96, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for oxolan-2-yl(thiophen-2-yl)methanol is sourced from PubChem (CID 61087499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).