6-[(2-methylpropan-2-yl)oxy]-3,6-dihydro-2H-pyran

C9H16O2 — CID 14202471

IUPAC6-[(2-methylpropan-2-yl)oxy]-3,6-dihydro-2H-pyran
SMILESCC(C)(C)OC1C=CCCO1
InChIInChI=1S/C9H16O2/c1-9(2,3)11-8-6-4-5-7-10-8/h4,6,8H,5,7H2,1-3H3
InChIKeyFJVYQLFIDMCQQO-UHFFFAOYSA-N
MW156.22 g/mol
LogP2.10
Rot. Bonds1

About 6-[(2-methylpropan-2-yl)oxy]-3,6-dihydro-2H-pyran

6-[(2-methylpropan-2-yl)oxy]-3,6-dihydro-2H-pyran (PubChem CID 14202471) has the molecular formula C9H16O2 and a molecular weight of 156.22 g/mol. Its IUPAC name is 6-[(2-methylpropan-2-yl)oxy]-3,6-dihydro-2H-pyran.

Molecular Properties

Compound Name6-[(2-methylpropan-2-yl)oxy]-3,6-dihydro-2H-pyran
PubChem CID14202471
Molecular FormulaC9H16O2
Molecular Weight156.22 g/mol
Exact Mass156.12
IUPAC Name6-[(2-methylpropan-2-yl)oxy]-3,6-dihydro-2H-pyran
SMILESCC(C)(C)OC1C=CCCO1
InChIInChI=1S/C9H16O2/c1-9(2,3)11-8-6-4-5-7-10-8/h4,6,8H,5,7H2,1-3H3
InChIKeyFJVYQLFIDMCQQO-UHFFFAOYSA-N
XLogP2.10
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.22
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 6-[(2-methylpropan-2-yl)oxy]-3,6-dihydro-2H-pyran with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(2-methylpropan-2-yl)oxy]-1,3-dioxolane
CID 23262085
3-[(2-methylpropan-2-yl)oxy]cyclohexa-1,4-diene
CID 69013227
(2R)-2-tert-butyl-4,5-dihydro-1,3-dioxepine
CID 11321086
methyl 2-[(6S)-3,6-dihydro-2H-pyran-6-yl]acetate
CID 131844999
(1S,2S,8aS)-1,2-bis[(2-methylpropan-2-yl)oxy]-1,2,3,5,6,8a-hexahydroindolizine
CID 11173191
trimethyl-[(1R,2Z,6Z,8R)-8-trimethylsilyloxycycloocta-2,6-dien-1-yl]oxysilane
CID 13049316
(3S,3aR,6S,6aR)-3,6-bis[(2-methylpropan-2-yl)oxy]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
CID 139315398
3-(2-cyclohex-2-en-1-yloxypropan-2-yloxy)cyclohexene
CID 141430712
6-(2-bromoethyl)-3,6-dihydro-2H-pyran
CID 11735653
7,12-bis[(2-methylpropan-2-yl)oxy]heptacyclo[6.6.0.02,6.03,13.04,11.05,9.010,14]tetradecane
CID 14220126
trans-(1R,2R)-1,2-bis[(2-methylpropan-2-yl)oxy]cyclobutane
CID 66800520
9-[(2-methylpropan-2-yl)oxy]-3,4-diazatricyclo[4.2.1.02,5]nona-3,7-diene
CID 86089939

Frequently Asked Questions

What is the IUPAC name of 6-[(2-methylpropan-2-yl)oxy]-3,6-dihydro-2H-pyran?
The IUPAC name of 6-[(2-methylpropan-2-yl)oxy]-3,6-dihydro-2H-pyran (CID 14202471) is 6-[(2-methylpropan-2-yl)oxy]-3,6-dihydro-2H-pyran.
What is the SMILES notation for 6-[(2-methylpropan-2-yl)oxy]-3,6-dihydro-2H-pyran?
The canonical SMILES for 6-[(2-methylpropan-2-yl)oxy]-3,6-dihydro-2H-pyran is CC(C)(C)OC1C=CCCO1.
What is the InChIKey of 6-[(2-methylpropan-2-yl)oxy]-3,6-dihydro-2H-pyran?
The InChIKey is FJVYQLFIDMCQQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O2/c1-9(2,3)11-8-6-4-5-7-10-8/h4,6,8H,5,7H2,1-3H3.
What are the key properties of 6-[(2-methylpropan-2-yl)oxy]-3,6-dihydro-2H-pyran?
6-[(2-methylpropan-2-yl)oxy]-3,6-dihydro-2H-pyran has a molecular weight of 156.22 g/mol, XLogP of 2.10, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-methylpropan-2-yl)oxy]-3,6-dihydro-2H-pyran is sourced from PubChem (CID 14202471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).