(4-fluoro-3-methylphenyl)-(4-propan-2-ylcyclohexyl)methanol

C17H25FO — CID 65424893

IUPAC(4-fluoro-3-methylphenyl)-(4-propan-2-ylcyclohexyl)methanol
SMILESCc1cc(C(O)C2CCC(C(C)C)CC2)ccc1F
InChIInChI=1S/C17H25FO/c1-11(2)13-4-6-14(7-5-13)17(19)15-8-9-16(18)12(3)10-15/h8-11,13-14,17,19H,4-7H2,1-3H3
InChIKeyGJRGIBFNFXZWCE-UHFFFAOYSA-N
MW264.38 g/mol
LogP4.63
Rot. Bonds3

About (4-fluoro-3-methylphenyl)-(4-propan-2-ylcyclohexyl)methanol

(4-fluoro-3-methylphenyl)-(4-propan-2-ylcyclohexyl)methanol (PubChem CID 65424893) has the molecular formula C17H25FO and a molecular weight of 264.38 g/mol. Its IUPAC name is (4-fluoro-3-methylphenyl)-(4-propan-2-ylcyclohexyl)methanol.

Molecular Properties

Compound Name(4-fluoro-3-methylphenyl)-(4-propan-2-ylcyclohexyl)methanol
PubChem CID65424893
Molecular FormulaC17H25FO
Molecular Weight264.38 g/mol
Exact Mass264.19
IUPAC Name(4-fluoro-3-methylphenyl)-(4-propan-2-ylcyclohexyl)methanol
SMILESCc1cc(C(O)C2CCC(C(C)C)CC2)ccc1F
InChIInChI=1S/C17H25FO/c1-11(2)13-4-6-14(7-5-13)17(19)15-8-9-16(18)12(3)10-15/h8-11,13-14,17,19H,4-7H2,1-3H3
InChIKeyGJRGIBFNFXZWCE-UHFFFAOYSA-N
XLogP4.63
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.38
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

cyclopentyl-(4-fluoro-3-methylphenyl)methanol
CID 60929105
(1R,2S)-2-amino-1-cyclopropyl-2-(4-fluoro-3-methylphenyl)ethanol
CID 171267876
(4-fluoro-3-methylphenyl)-piperidin-3-ylmethanol
CID 79023931
2-cyclohexyl-1-(4-fluoro-3-methylphenyl)ethanol
CID 55095037
(4-propan-2-ylcyclohexyl)-(2,3,4-trifluorophenyl)methanol
CID 65425286
(4-fluoro-3-methylphenyl)methanediol
CID 45090626
(4-fluoro-3-methylphenyl)-(5-oxaspiro[3.5]nonan-8-yl)methanol
CID 79912706
1-cyclopropyl-N-[1-(4-fluoro-3-methylphenyl)ethyl]ethanamine;hydrochloride
CID 115683937
(1S,2R)-2-amino-1-cyclobutyl-2-(4-fluoro-3-methylphenyl)ethanol
CID 171262203
(R)-cyclohexyl-(3,4-difluorophenyl)methanol
CID 93184618
(S)-cyclohexyl-(3,4-difluorophenyl)methanol
CID 93184621
1-(4-fluoro-3-methylphenyl)-3-methylbutan-1-ol
CID 60929106

Frequently Asked Questions

What is the IUPAC name of (4-fluoro-3-methylphenyl)-(4-propan-2-ylcyclohexyl)methanol?
The IUPAC name of (4-fluoro-3-methylphenyl)-(4-propan-2-ylcyclohexyl)methanol (CID 65424893) is (4-fluoro-3-methylphenyl)-(4-propan-2-ylcyclohexyl)methanol.
What is the SMILES notation for (4-fluoro-3-methylphenyl)-(4-propan-2-ylcyclohexyl)methanol?
The canonical SMILES for (4-fluoro-3-methylphenyl)-(4-propan-2-ylcyclohexyl)methanol is Cc1cc(C(O)C2CCC(C(C)C)CC2)ccc1F.
What is the InChIKey of (4-fluoro-3-methylphenyl)-(4-propan-2-ylcyclohexyl)methanol?
The InChIKey is GJRGIBFNFXZWCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25FO/c1-11(2)13-4-6-14(7-5-13)17(19)15-8-9-16(18)12(3)10-15/h8-11,13-14,17,19H,4-7H2,1-3H3.
What are the key properties of (4-fluoro-3-methylphenyl)-(4-propan-2-ylcyclohexyl)methanol?
(4-fluoro-3-methylphenyl)-(4-propan-2-ylcyclohexyl)methanol has a molecular weight of 264.38 g/mol, XLogP of 4.63, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluoro-3-methylphenyl)-(4-propan-2-ylcyclohexyl)methanol is sourced from PubChem (CID 65424893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).