4-ethyl-4-methyl-2,3-dihydropyran

C8H14O — CID 13464500

IUPAC4-ethyl-4-methyl-2,3-dihydropyran
SMILESCCC1(C)C=COCC1
InChIInChI=1S/C8H14O/c1-3-8(2)4-6-9-7-5-8/h4,6H,3,5,7H2,1-2H3
InChIKeyRRDPASWSAMVYPL-UHFFFAOYSA-N
MW126.20 g/mol
LogP2.34
Rot. Bonds1

About 4-ethyl-4-methyl-2,3-dihydropyran

4-ethyl-4-methyl-2,3-dihydropyran (PubChem CID 13464500) has the molecular formula C8H14O and a molecular weight of 126.20 g/mol. Its IUPAC name is 4-ethyl-4-methyl-2,3-dihydropyran.

Molecular Properties

Compound Name4-ethyl-4-methyl-2,3-dihydropyran
PubChem CID13464500
Molecular FormulaC8H14O
Molecular Weight126.20 g/mol
Exact Mass126.10
IUPAC Name4-ethyl-4-methyl-2,3-dihydropyran
SMILESCCC1(C)C=COCC1
InChIInChI=1S/C8H14O/c1-3-8(2)4-6-9-7-5-8/h4,6H,3,5,7H2,1-2H3
InChIKeyRRDPASWSAMVYPL-UHFFFAOYSA-N
XLogP2.34
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-Ethyl-2,3-dihydropyran
CID 70641358
Divinyltetrahydropyran
CID 129699652
4,4-Dimethyl-3,4-dihydro-2H-pyran
CID 14903586
3,3-dimethyl-3,4-dihydro-2H-pyran
CID 19101881
4-tert-butyl-3,4-dihydro-2H-pyran
CID 21763337
4,4-Di(propan-2-yl)-2,3-dihydropyran
CID 58056047
3,3-Di(propan-2-yl)-2,4-dihydropyran
CID 58056082
3-Methyl-3-propan-2-yl-2,4-dihydropyran
CID 68060337
4-Ethenyl-4-methyloxane
CID 89529214
4-Ethenyl-4-ethyloxane
CID 135133669
3,3-Dimethyl-2,4-dihydropyran;ethane
CID 142157770
(4S)-4-ethyl-4-methyl-2,3-dihydropyran
CID 143018886

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-4-methyl-2,3-dihydropyran?
The IUPAC name of 4-ethyl-4-methyl-2,3-dihydropyran (CID 13464500) is 4-ethyl-4-methyl-2,3-dihydropyran.
What is the SMILES notation for 4-ethyl-4-methyl-2,3-dihydropyran?
The canonical SMILES for 4-ethyl-4-methyl-2,3-dihydropyran is CCC1(C)C=COCC1.
What is the InChIKey of 4-ethyl-4-methyl-2,3-dihydropyran?
The InChIKey is RRDPASWSAMVYPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O/c1-3-8(2)4-6-9-7-5-8/h4,6H,3,5,7H2,1-2H3.
What are the key properties of 4-ethyl-4-methyl-2,3-dihydropyran?
4-ethyl-4-methyl-2,3-dihydropyran has a molecular weight of 126.20 g/mol, XLogP of 2.34, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-4-methyl-2,3-dihydropyran is sourced from PubChem (CID 13464500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).