6-fluoro-5-methyl-2-[2-(4-methylcyclohexyl)ethyl]-3,4-dihydro-2H-pyran

C15H25FO — CID 54169397

IUPAC6-fluoro-5-methyl-2-[2-(4-methylcyclohexyl)ethyl]-3,4-dihydro-2H-pyran
SMILESCC1=C(F)OC(CCC2CCC(C)CC2)CC1
InChIInChI=1S/C15H25FO/c1-11-3-6-13(7-4-11)8-10-14-9-5-12(2)15(16)17-14/h11,13-14H,3-10H2,1-2H3
InChIKeyOTYDFZZBOYLYKB-UHFFFAOYSA-N
MW240.36 g/mol
LogP4.97
Rot. Bonds3

About 6-fluoro-5-methyl-2-[2-(4-methylcyclohexyl)ethyl]-3,4-dihydro-2H-pyran

6-fluoro-5-methyl-2-[2-(4-methylcyclohexyl)ethyl]-3,4-dihydro-2H-pyran (PubChem CID 54169397) has the molecular formula C15H25FO and a molecular weight of 240.36 g/mol. Its IUPAC name is 6-fluoro-5-methyl-2-[2-(4-methylcyclohexyl)ethyl]-3,4-dihydro-2H-pyran.

Molecular Properties

Compound Name6-fluoro-5-methyl-2-[2-(4-methylcyclohexyl)ethyl]-3,4-dihydro-2H-pyran
PubChem CID54169397
Molecular FormulaC15H25FO
Molecular Weight240.36 g/mol
Exact Mass240.19
IUPAC Name6-fluoro-5-methyl-2-[2-(4-methylcyclohexyl)ethyl]-3,4-dihydro-2H-pyran
SMILESCC1=C(F)OC(CCC2CCC(C)CC2)CC1
InChIInChI=1S/C15H25FO/c1-11-3-6-13(7-4-11)8-10-14-9-5-12(2)15(16)17-14/h11,13-14H,3-10H2,1-2H3
InChIKeyOTYDFZZBOYLYKB-UHFFFAOYSA-N
XLogP4.97
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.36
LogP ≤ 54.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-fluoro-5-methyl-2-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]-3,4-dihydro-2H-pyran
CID 53722470
2-[4-(3,3-difluoro-4-methylcyclohexyl)cyclohexyl]-6-fluoro-5-methyl-3,4-dihydro-2H-pyran
CID 53866172
6-fluoro-2-[4-(3-fluoro-4-methylcyclohex-3-en-1-yl)cyclohexyl]-5-methyl-3,4-dihydro-2H-pyran
CID 53884891
6-fluoro-5-methyl-2-[4-(5-methyloxan-2-yl)cyclohexyl]-3,4-dihydro-2H-pyran
CID 54037797
6-fluoro-5-methyl-2-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]-3,4-dihydro-2H-pyran
CID 54116088
6-fluoro-5-methyl-2-[4-(4-methylcyclohexyl)cyclohexyl]-3,4-dihydro-2H-pyran
CID 54193750
6-fluoro-5-methyl-2-[4-[4-(4-methylcyclohexyl)cyclohexyl]cyclohexyl]-3,4-dihydro-2H-pyran
CID 54404054
6-fluoro-5-methyl-2-(4-methylcyclohexyl)-3,4-dihydro-2H-pyran
CID 54432588
2-[4-(Difluoromethylidene)cyclohexyl]-5-methyloxane
CID 57987751
1-Butyl-4-(1-ethoxypropa-1,2-dienyl)-1-fluorocyclohexane
CID 117746104
2-[4-(Difluoromethylidene)cyclohexyl]-5-propyloxane
CID 118601403
6-(1-fluoroethyl)-5-methyl-3-(4-methylcyclohexyl)-3,4-dihydro-2H-pyran
CID 143211267

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-5-methyl-2-[2-(4-methylcyclohexyl)ethyl]-3,4-dihydro-2H-pyran?
The IUPAC name of 6-fluoro-5-methyl-2-[2-(4-methylcyclohexyl)ethyl]-3,4-dihydro-2H-pyran (CID 54169397) is 6-fluoro-5-methyl-2-[2-(4-methylcyclohexyl)ethyl]-3,4-dihydro-2H-pyran.
What is the SMILES notation for 6-fluoro-5-methyl-2-[2-(4-methylcyclohexyl)ethyl]-3,4-dihydro-2H-pyran?
The canonical SMILES for 6-fluoro-5-methyl-2-[2-(4-methylcyclohexyl)ethyl]-3,4-dihydro-2H-pyran is CC1=C(F)OC(CCC2CCC(C)CC2)CC1.
What is the InChIKey of 6-fluoro-5-methyl-2-[2-(4-methylcyclohexyl)ethyl]-3,4-dihydro-2H-pyran?
The InChIKey is OTYDFZZBOYLYKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25FO/c1-11-3-6-13(7-4-11)8-10-14-9-5-12(2)15(16)17-14/h11,13-14H,3-10H2,1-2H3.
What are the key properties of 6-fluoro-5-methyl-2-[2-(4-methylcyclohexyl)ethyl]-3,4-dihydro-2H-pyran?
6-fluoro-5-methyl-2-[2-(4-methylcyclohexyl)ethyl]-3,4-dihydro-2H-pyran has a molecular weight of 240.36 g/mol, XLogP of 4.97, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-5-methyl-2-[2-(4-methylcyclohexyl)ethyl]-3,4-dihydro-2H-pyran is sourced from PubChem (CID 54169397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).