3-ethyl-2H-pyran-2-ol

C7H10O2 — CID 154393502

IUPAC3-ethyl-2H-pyran-2-ol
SMILESCCC1=CC=COC1O
InChIInChI=1S/C7H10O2/c1-2-6-4-3-5-9-7(6)8/h3-5,7-8H,2H2,1H3
InChIKeyLMNZBYVAGACZQC-UHFFFAOYSA-N
MW126.15 g/mol
LogP1.19
Rot. Bonds1

About 3-ethyl-2H-pyran-2-ol

3-ethyl-2H-pyran-2-ol (PubChem CID 154393502) has the molecular formula C7H10O2 and a molecular weight of 126.15 g/mol. Its IUPAC name is 3-ethyl-2H-pyran-2-ol.

Molecular Properties

Compound Name3-ethyl-2H-pyran-2-ol
PubChem CID154393502
Molecular FormulaC7H10O2
Molecular Weight126.15 g/mol
Exact Mass126.07
IUPAC Name3-ethyl-2H-pyran-2-ol
SMILESCCC1=CC=COC1O
InChIInChI=1S/C7H10O2/c1-2-6-4-3-5-9-7(6)8/h3-5,7-8H,2H2,1H3
InChIKeyLMNZBYVAGACZQC-UHFFFAOYSA-N
XLogP1.19
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.15
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-3-(trifluoromethyl)-2H-pyran-2-ol
CID 90002737
4-methyl-2H-pyran-2-ol
CID 20025856
5-methylidene-2H-pyran-6-ol
CID 57221857
7,7-dimethyl-1H-cyclopenta[c]pyran-1-ol
CID 57317710
3,5-dimethyl-2H-pyran-2-ol
CID 68719754
3-methyl-2H-pyran-2-ol
CID 68804298
3-ethenyl-2H-pyran-2-ol
CID 68979565
3-(2-trimethoxysilylethyl)-2H-pyran-2-ol
CID 69400081
3-(2-triethoxysilylethyl)-2H-pyran-2-ol
CID 69400903
Methoxy-(4-methoxycyclohexa-1,3-dien-1-yl)methanol
CID 89339403
1,5-Dimethoxy-2-methylidenehexa-3,5-dien-1-ol
CID 123480180
1-Methoxy-2-methylidenehexa-3,5-dien-1-ol
CID 123691440

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2H-pyran-2-ol?
The IUPAC name of 3-ethyl-2H-pyran-2-ol (CID 154393502) is 3-ethyl-2H-pyran-2-ol.
What is the SMILES notation for 3-ethyl-2H-pyran-2-ol?
The canonical SMILES for 3-ethyl-2H-pyran-2-ol is CCC1=CC=COC1O.
What is the InChIKey of 3-ethyl-2H-pyran-2-ol?
The InChIKey is LMNZBYVAGACZQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10O2/c1-2-6-4-3-5-9-7(6)8/h3-5,7-8H,2H2,1H3.
What are the key properties of 3-ethyl-2H-pyran-2-ol?
3-ethyl-2H-pyran-2-ol has a molecular weight of 126.15 g/mol, XLogP of 1.19, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2H-pyran-2-ol is sourced from PubChem (CID 154393502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).