3-methyl-2-thiophen-3-ylpentan-2-ol

C10H16OS — CID 65100069

IUPAC3-methyl-2-thiophen-3-ylpentan-2-ol
SMILESCCC(C)C(C)(O)c1ccsc1
InChIInChI=1S/C10H16OS/c1-4-8(2)10(3,11)9-5-6-12-7-9/h5-8,11H,4H2,1-3H3
InChIKeyHUZIDXSEVIDWGO-UHFFFAOYSA-N
MW184.30 g/mol
LogP3.00
Rot. Bonds3

About 3-methyl-2-thiophen-3-ylpentan-2-ol

3-methyl-2-thiophen-3-ylpentan-2-ol (PubChem CID 65100069) has the molecular formula C10H16OS and a molecular weight of 184.30 g/mol. Its IUPAC name is 3-methyl-2-thiophen-3-ylpentan-2-ol.

Molecular Properties

Compound Name3-methyl-2-thiophen-3-ylpentan-2-ol
PubChem CID65100069
Molecular FormulaC10H16OS
Molecular Weight184.30 g/mol
Exact Mass184.09
IUPAC Name3-methyl-2-thiophen-3-ylpentan-2-ol
SMILESCCC(C)C(C)(O)c1ccsc1
InChIInChI=1S/C10H16OS/c1-4-8(2)10(3,11)9-5-6-12-7-9/h5-8,11H,4H2,1-3H3
InChIKeyHUZIDXSEVIDWGO-UHFFFAOYSA-N
XLogP3.00
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.30
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-2-phenylpentan-2-ol
CID 13024634
2-(4-bromophenyl)-3-methylpentan-2-ol
CID 79445926
3-thiophen-3-ylpentan-3-ol
CID 65099780
ethane;2-thiophen-3-ylpropan-2-ol
CID 144659448
3-thiophen-3-ylpent-1-en-3-ol
CID 130929664
4-amino-3,3-dimethyl-2-thiophen-3-ylbutan-2-ol
CID 127003873
1-[1-(aminomethyl)cyclopropyl]-1-thiophen-3-ylethanol
CID 131210776
bis(methylamino)-thiophen-3-ylmethanol
CID 126493654
3-thiophen-3-ylpentan-3-amine
CID 65099925
5-[(2-hydroxy-2-thiophen-3-ylpropyl)amino]-3-methylheptan-3-ol
CID 154766369
2-(3-fluoro-5-methylphenyl)-3-methylpentan-2-ol
CID 79692026
2-methyl-3-thiophen-3-ylpent-1-en-3-ol
CID 131021089

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-thiophen-3-ylpentan-2-ol?
The IUPAC name of 3-methyl-2-thiophen-3-ylpentan-2-ol (CID 65100069) is 3-methyl-2-thiophen-3-ylpentan-2-ol.
What is the SMILES notation for 3-methyl-2-thiophen-3-ylpentan-2-ol?
The canonical SMILES for 3-methyl-2-thiophen-3-ylpentan-2-ol is CCC(C)C(C)(O)c1ccsc1.
What is the InChIKey of 3-methyl-2-thiophen-3-ylpentan-2-ol?
The InChIKey is HUZIDXSEVIDWGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16OS/c1-4-8(2)10(3,11)9-5-6-12-7-9/h5-8,11H,4H2,1-3H3.
What are the key properties of 3-methyl-2-thiophen-3-ylpentan-2-ol?
3-methyl-2-thiophen-3-ylpentan-2-ol has a molecular weight of 184.30 g/mol, XLogP of 3.00, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-thiophen-3-ylpentan-2-ol is sourced from PubChem (CID 65100069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).