2-methoxy-1-thiophen-3-ylpentan-1-ol

C10H16O2S — CID 116711807

IUPAC2-methoxy-1-thiophen-3-ylpentan-1-ol
SMILESCCCC(OC)C(O)c1ccsc1
InChIInChI=1S/C10H16O2S/c1-3-4-9(12-2)10(11)8-5-6-13-7-8/h5-7,9-11H,3-4H2,1-2H3
InChIKeyHZXWPNZIERDTLO-UHFFFAOYSA-N
MW200.30 g/mol
LogP2.60
Rot. Bonds5

About 2-methoxy-1-thiophen-3-ylpentan-1-ol

2-methoxy-1-thiophen-3-ylpentan-1-ol (PubChem CID 116711807) has the molecular formula C10H16O2S and a molecular weight of 200.30 g/mol. Its IUPAC name is 2-methoxy-1-thiophen-3-ylpentan-1-ol.

Molecular Properties

Compound Name2-methoxy-1-thiophen-3-ylpentan-1-ol
PubChem CID116711807
Molecular FormulaC10H16O2S
Molecular Weight200.30 g/mol
Exact Mass200.09
IUPAC Name2-methoxy-1-thiophen-3-ylpentan-1-ol
SMILESCCCC(OC)C(O)c1ccsc1
InChIInChI=1S/C10H16O2S/c1-3-4-9(12-2)10(11)8-5-6-13-7-8/h5-7,9-11H,3-4H2,1-2H3
InChIKeyHZXWPNZIERDTLO-UHFFFAOYSA-N
XLogP2.60
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.30
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-thiophen-3-ylpentan-1-ol?
The IUPAC name of 2-methoxy-1-thiophen-3-ylpentan-1-ol (CID 116711807) is 2-methoxy-1-thiophen-3-ylpentan-1-ol.
What is the SMILES notation for 2-methoxy-1-thiophen-3-ylpentan-1-ol?
The canonical SMILES for 2-methoxy-1-thiophen-3-ylpentan-1-ol is CCCC(OC)C(O)c1ccsc1.
What is the InChIKey of 2-methoxy-1-thiophen-3-ylpentan-1-ol?
The InChIKey is HZXWPNZIERDTLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O2S/c1-3-4-9(12-2)10(11)8-5-6-13-7-8/h5-7,9-11H,3-4H2,1-2H3.
What are the key properties of 2-methoxy-1-thiophen-3-ylpentan-1-ol?
2-methoxy-1-thiophen-3-ylpentan-1-ol has a molecular weight of 200.30 g/mol, XLogP of 2.60, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-thiophen-3-ylpentan-1-ol is sourced from PubChem (CID 116711807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).