6-methyl-6-(2-methylpropyl)-2,5-dihydropyran

C10H18O — CID 102021053

IUPAC6-methyl-6-(2-methylpropyl)-2,5-dihydropyran
SMILESCC(C)CC1(C)CC=CCO1
InChIInChI=1S/C10H18O/c1-9(2)8-10(3)6-4-5-7-11-10/h4-5,9H,6-8H2,1-3H3
InChIKeyDRCYRRSUJKRNKO-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.77
Rot. Bonds2

About 6-methyl-6-(2-methylpropyl)-2,5-dihydropyran

6-methyl-6-(2-methylpropyl)-2,5-dihydropyran (PubChem CID 102021053) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 6-methyl-6-(2-methylpropyl)-2,5-dihydropyran.

Molecular Properties

Compound Name6-methyl-6-(2-methylpropyl)-2,5-dihydropyran
PubChem CID102021053
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name6-methyl-6-(2-methylpropyl)-2,5-dihydropyran
SMILESCC(C)CC1(C)CC=CCO1
InChIInChI=1S/C10H18O/c1-9(2)8-10(3)6-4-5-7-11-10/h4-5,9H,6-8H2,1-3H3
InChIKeyDRCYRRSUJKRNKO-UHFFFAOYSA-N
XLogP2.77
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
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'}

Analyze 6-methyl-6-(2-methylpropyl)-2,5-dihydropyran 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

2,6,9,10-Tetramethyl-1-oxaspiro(4.5)deca-3,6-diene
CID 116740
Ethyl linalyl ether
CID 175211
2-Butyl-5,6-dihydro-2,4-dimethyl-2H-pyran
CID 3017306
5,6-dihydro-4-methyl-2-(2-methylpropyl)-2H-pyran
CID 108398
3,6-dihydro-4-methyl-2-(2-methylpropyl)-2H-pyran
CID 108400
1-Ethoxy-p-menth-2-ene
CID 92004572
Tert-butyl cyclohex-2-en-1-yl ether
CID 287916
2-Isopropyl-4-methyl-3,6-dihydro-2h-pyran
CID 12283089
2-Methyl-2-propyl-2,5-dihydrofuran
CID 12507025
[(E)-3-ethoxyprop-1-enyl]cyclohexane
CID 5358350
6-Ethyl-2,6-dimethyl-2,3-dihydropyran
CID 12507029
2,2-Dibutyl-2,5-dihydrofuran
CID 57702318

Frequently Asked Questions

What is the IUPAC name of 6-methyl-6-(2-methylpropyl)-2,5-dihydropyran?
The IUPAC name of 6-methyl-6-(2-methylpropyl)-2,5-dihydropyran (CID 102021053) is 6-methyl-6-(2-methylpropyl)-2,5-dihydropyran.
What is the SMILES notation for 6-methyl-6-(2-methylpropyl)-2,5-dihydropyran?
The canonical SMILES for 6-methyl-6-(2-methylpropyl)-2,5-dihydropyran is CC(C)CC1(C)CC=CCO1.
What is the InChIKey of 6-methyl-6-(2-methylpropyl)-2,5-dihydropyran?
The InChIKey is DRCYRRSUJKRNKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-9(2)8-10(3)6-4-5-7-11-10/h4-5,9H,6-8H2,1-3H3.
What are the key properties of 6-methyl-6-(2-methylpropyl)-2,5-dihydropyran?
6-methyl-6-(2-methylpropyl)-2,5-dihydropyran has a molecular weight of 154.25 g/mol, XLogP of 2.77, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-6-(2-methylpropyl)-2,5-dihydropyran is sourced from PubChem (CID 102021053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).