1-(3-fluoropropyl)-4-methylcyclohexane

C10H19F — CID 166888842

IUPAC1-(3-fluoropropyl)-4-methylcyclohexane
SMILESCC1CCC(CCCF)CC1
InChIInChI=1S/C10H19F/c1-9-4-6-10(7-5-9)3-2-8-11/h9-10H,2-8H2,1H3
InChIKeyKNANIHOXHAVPTJ-UHFFFAOYSA-N
MW158.26 g/mol
LogP3.56
Rot. Bonds3

About 1-(3-fluoropropyl)-4-methylcyclohexane

1-(3-fluoropropyl)-4-methylcyclohexane (PubChem CID 166888842) has the molecular formula C10H19F and a molecular weight of 158.26 g/mol. Its IUPAC name is 1-(3-fluoropropyl)-4-methylcyclohexane.

Molecular Properties

Compound Name1-(3-fluoropropyl)-4-methylcyclohexane
PubChem CID166888842
Molecular FormulaC10H19F
Molecular Weight158.26 g/mol
Exact Mass158.15
IUPAC Name1-(3-fluoropropyl)-4-methylcyclohexane
SMILESCC1CCC(CCCF)CC1
InChIInChI=1S/C10H19F/c1-9-4-6-10(7-5-9)3-2-8-11/h9-10H,2-8H2,1H3
InChIKeyKNANIHOXHAVPTJ-UHFFFAOYSA-N
XLogP3.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.26
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-[4-(3-fluoropropyl)cyclohexyl]-4-(4-octylcyclohexyl)cyclohexane
CID 54536291
1-[4-(3-fluoropropyl)cyclohexyl]-4-(4-heptylcyclohexyl)cyclohexane
CID 54105459
3-(4-methylcyclohexyl)propane-1-thiol
CID 139295204
1-(3-chloropropyl)-4-methylcyclohexane
CID 64775932
1-[4-(7-fluorohept-4-enyl)cyclohexyl]-4-(4-methylcyclohexyl)cyclohexane
CID 54243786
1-[4-(3-fluoropropyl)cyclohexyl]-4-[2-(4-hexylcyclohexyl)ethyl]cyclohexane
CID 19352474
1-(fluoromethyl)-4-methylcyclohexane
CID 20579841
dimethoxy-[3-(4-methylcyclohexyl)propyl]silane
CID 154017104
1-butyl-4-methylcyclooctane
CID 123623113
1-(3-fluoropropyl)-4-[4-(methoxymethyl)cyclohexyl]cyclohexane
CID 19780918
1-(8-fluorooctyl)-4-[4-[4-(5-fluoropentyl)cyclohexyl]cyclohexyl]cyclohexane
CID 54035410
1-hexyl-4-(4-methylcyclohexyl)cyclohexane
CID 19850428

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoropropyl)-4-methylcyclohexane?
The IUPAC name of 1-(3-fluoropropyl)-4-methylcyclohexane (CID 166888842) is 1-(3-fluoropropyl)-4-methylcyclohexane.
What is the SMILES notation for 1-(3-fluoropropyl)-4-methylcyclohexane?
The canonical SMILES for 1-(3-fluoropropyl)-4-methylcyclohexane is CC1CCC(CCCF)CC1.
What is the InChIKey of 1-(3-fluoropropyl)-4-methylcyclohexane?
The InChIKey is KNANIHOXHAVPTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F/c1-9-4-6-10(7-5-9)3-2-8-11/h9-10H,2-8H2,1H3.
What are the key properties of 1-(3-fluoropropyl)-4-methylcyclohexane?
1-(3-fluoropropyl)-4-methylcyclohexane has a molecular weight of 158.26 g/mol, XLogP of 3.56, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoropropyl)-4-methylcyclohexane is sourced from PubChem (CID 166888842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).