3-methyl-5-thiophen-2-ylpentan-1-ol

C10H16OS — CID 23272364

IUPAC3-methyl-5-thiophen-2-ylpentan-1-ol
SMILESCC(CCO)CCc1cccs1
InChIInChI=1S/C10H16OS/c1-9(6-7-11)4-5-10-3-2-8-12-10/h2-3,8-9,11H,4-7H2,1H3
InChIKeyYYKILCHFECCERR-UHFFFAOYSA-N
MW184.30 g/mol
LogP2.70
Rot. Bonds5

About 3-methyl-5-thiophen-2-ylpentan-1-ol

3-methyl-5-thiophen-2-ylpentan-1-ol (PubChem CID 23272364) has the molecular formula C10H16OS and a molecular weight of 184.30 g/mol. Its IUPAC name is 3-methyl-5-thiophen-2-ylpentan-1-ol.

Molecular Properties

Compound Name3-methyl-5-thiophen-2-ylpentan-1-ol
PubChem CID23272364
Molecular FormulaC10H16OS
Molecular Weight184.30 g/mol
Exact Mass184.09
IUPAC Name3-methyl-5-thiophen-2-ylpentan-1-ol
SMILESCC(CCO)CCc1cccs1
InChIInChI=1S/C10H16OS/c1-9(6-7-11)4-5-10-3-2-8-12-10/h2-3,8-9,11H,4-7H2,1H3
InChIKeyYYKILCHFECCERR-UHFFFAOYSA-N
XLogP2.70
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.30
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-thiophen-2-ylpentan-1-ol?
The IUPAC name of 3-methyl-5-thiophen-2-ylpentan-1-ol (CID 23272364) is 3-methyl-5-thiophen-2-ylpentan-1-ol.
What is the SMILES notation for 3-methyl-5-thiophen-2-ylpentan-1-ol?
The canonical SMILES for 3-methyl-5-thiophen-2-ylpentan-1-ol is CC(CCO)CCc1cccs1.
What is the InChIKey of 3-methyl-5-thiophen-2-ylpentan-1-ol?
The InChIKey is YYKILCHFECCERR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16OS/c1-9(6-7-11)4-5-10-3-2-8-12-10/h2-3,8-9,11H,4-7H2,1H3.
What are the key properties of 3-methyl-5-thiophen-2-ylpentan-1-ol?
3-methyl-5-thiophen-2-ylpentan-1-ol has a molecular weight of 184.30 g/mol, XLogP of 2.70, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-thiophen-2-ylpentan-1-ol is sourced from PubChem (CID 23272364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).