2-(5-methyl-2-propan-2-ylcyclohexyl)-2H-pyran

C15H24O — CID 67905688

IUPAC2-(5-methyl-2-propan-2-ylcyclohexyl)-2H-pyran
SMILESCC1CCC(C(C)C)C(C2C=CC=CO2)C1
InChIInChI=1S/C15H24O/c1-11(2)13-8-7-12(3)10-14(13)15-6-4-5-9-16-15/h4-6,9,11-15H,7-8,10H2,1-3H3
InChIKeyDZDWRQARYMVWLS-UHFFFAOYSA-N
MW220.36 g/mol
LogP4.16
Rot. Bonds2

About 2-(5-methyl-2-propan-2-ylcyclohexyl)-2H-pyran

2-(5-methyl-2-propan-2-ylcyclohexyl)-2H-pyran (PubChem CID 67905688) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is 2-(5-methyl-2-propan-2-ylcyclohexyl)-2H-pyran.

Molecular Properties

Compound Name2-(5-methyl-2-propan-2-ylcyclohexyl)-2H-pyran
PubChem CID67905688
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name2-(5-methyl-2-propan-2-ylcyclohexyl)-2H-pyran
SMILESCC1CCC(C(C)C)C(C2C=CC=CO2)C1
InChIInChI=1S/C15H24O/c1-11(2)13-8-7-12(3)10-14(13)15-6-4-5-9-16-15/h4-6,9,11-15H,7-8,10H2,1-3H3
InChIKeyDZDWRQARYMVWLS-UHFFFAOYSA-N
XLogP4.16
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-2-propan-2-ylcyclohexyl)-2H-pyran?
The IUPAC name of 2-(5-methyl-2-propan-2-ylcyclohexyl)-2H-pyran (CID 67905688) is 2-(5-methyl-2-propan-2-ylcyclohexyl)-2H-pyran.
What is the SMILES notation for 2-(5-methyl-2-propan-2-ylcyclohexyl)-2H-pyran?
The canonical SMILES for 2-(5-methyl-2-propan-2-ylcyclohexyl)-2H-pyran is CC1CCC(C(C)C)C(C2C=CC=CO2)C1.
What is the InChIKey of 2-(5-methyl-2-propan-2-ylcyclohexyl)-2H-pyran?
The InChIKey is DZDWRQARYMVWLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O/c1-11(2)13-8-7-12(3)10-14(13)15-6-4-5-9-16-15/h4-6,9,11-15H,7-8,10H2,1-3H3.
What are the key properties of 2-(5-methyl-2-propan-2-ylcyclohexyl)-2H-pyran?
2-(5-methyl-2-propan-2-ylcyclohexyl)-2H-pyran has a molecular weight of 220.36 g/mol, XLogP of 4.16, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-2-propan-2-ylcyclohexyl)-2H-pyran is sourced from PubChem (CID 67905688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).