6,6-dimethyl-5-propan-2-yl-2,3-dihydropyran

C10H18O — CID 14593317

IUPAC6,6-dimethyl-5-propan-2-yl-2,3-dihydropyran
SMILESCC(C)C1=CCCOC1(C)C
InChIInChI=1S/C10H18O/c1-8(2)9-6-5-7-11-10(9,3)4/h6,8H,5,7H2,1-4H3
InChIKeyCVQPHBFODMQHLY-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.77
Rot. Bonds1

About 6,6-dimethyl-5-propan-2-yl-2,3-dihydropyran

6,6-dimethyl-5-propan-2-yl-2,3-dihydropyran (PubChem CID 14593317) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 6,6-dimethyl-5-propan-2-yl-2,3-dihydropyran.

Molecular Properties

Compound Name6,6-dimethyl-5-propan-2-yl-2,3-dihydropyran
PubChem CID14593317
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name6,6-dimethyl-5-propan-2-yl-2,3-dihydropyran
SMILESCC(C)C1=CCCOC1(C)C
InChIInChI=1S/C10H18O/c1-8(2)9-6-5-7-11-10(9,3)4/h6,8H,5,7H2,1-4H3
InChIKeyCVQPHBFODMQHLY-UHFFFAOYSA-N
XLogP2.77
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(+-)-Nerol oxide
CID 61275
Ethyl linalyl ether
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2-Butyl-5,6-dihydro-2,4-dimethyl-2H-pyran
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5,6-dihydro-4-methyl-2-(2-methylpropyl)-2H-pyran
CID 108398
3,6-dihydro-4-methyl-2-(2-methylpropyl)-2H-pyran
CID 108400
(2S)-4-methyl-2-(2-methylprop-1-enyl)-3,6-dihydro-2H-pyran
CID 11062576
2H-Pyran, 5,6-dihydro-4,5-dimethyl-2-(2-methyl-1-propen-1-yl)-
CID 103463
(2E)-1-[(3S)-3,7-dimethylocta-1,6-dien-3-yl]oxy-3,7-dimethylocta-2,6-diene
CID 162880600
(3S,6S)-3,6-dimethoxy-1-methyl-4-propan-2-ylcyclohexa-1,4-diene
CID 162982358
2,2-Dimethyl-4-ethynyl-3,6-dihydro-2H-pyran
CID 564308
2-Isopropyl-4-methyl-3,6-dihydro-2h-pyran
CID 12283089
5-Isopropenyl-3-isopropyl-2,2-dimethyl-2,5-dihydrofuran
CID 596568

Frequently Asked Questions

What is the IUPAC name of 6,6-dimethyl-5-propan-2-yl-2,3-dihydropyran?
The IUPAC name of 6,6-dimethyl-5-propan-2-yl-2,3-dihydropyran (CID 14593317) is 6,6-dimethyl-5-propan-2-yl-2,3-dihydropyran.
What is the SMILES notation for 6,6-dimethyl-5-propan-2-yl-2,3-dihydropyran?
The canonical SMILES for 6,6-dimethyl-5-propan-2-yl-2,3-dihydropyran is CC(C)C1=CCCOC1(C)C.
What is the InChIKey of 6,6-dimethyl-5-propan-2-yl-2,3-dihydropyran?
The InChIKey is CVQPHBFODMQHLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-8(2)9-6-5-7-11-10(9,3)4/h6,8H,5,7H2,1-4H3.
What are the key properties of 6,6-dimethyl-5-propan-2-yl-2,3-dihydropyran?
6,6-dimethyl-5-propan-2-yl-2,3-dihydropyran has a molecular weight of 154.25 g/mol, XLogP of 2.77, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-dimethyl-5-propan-2-yl-2,3-dihydropyran is sourced from PubChem (CID 14593317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).