[2-cyclohexyl-1-(4-fluorophenyl)cyclopropyl]methanol

C16H21FO — CID 67084504

IUPAC[2-cyclohexyl-1-(4-fluorophenyl)cyclopropyl]methanol
SMILESOCC1(c2ccc(F)cc2)CC1C1CCCCC1
InChIInChI=1S/C16H21FO/c17-14-8-6-13(7-9-14)16(11-18)10-15(16)12-4-2-1-3-5-12/h6-9,12,15,18H,1-5,10-11H2
InChIKeyPBKVOXONZHBADH-UHFFFAOYSA-N
MW248.34 g/mol
LogP3.66
Rot. Bonds3

About [2-cyclohexyl-1-(4-fluorophenyl)cyclopropyl]methanol

[2-cyclohexyl-1-(4-fluorophenyl)cyclopropyl]methanol (PubChem CID 67084504) has the molecular formula C16H21FO and a molecular weight of 248.34 g/mol. Its IUPAC name is [2-cyclohexyl-1-(4-fluorophenyl)cyclopropyl]methanol.

Molecular Properties

Compound Name[2-cyclohexyl-1-(4-fluorophenyl)cyclopropyl]methanol
PubChem CID67084504
Molecular FormulaC16H21FO
Molecular Weight248.34 g/mol
Exact Mass248.16
IUPAC Name[2-cyclohexyl-1-(4-fluorophenyl)cyclopropyl]methanol
SMILESOCC1(c2ccc(F)cc2)CC1C1CCCCC1
InChIInChI=1S/C16H21FO/c17-14-8-6-13(7-9-14)16(11-18)10-15(16)12-4-2-1-3-5-12/h6-9,12,15,18H,1-5,10-11H2
InChIKeyPBKVOXONZHBADH-UHFFFAOYSA-N
XLogP3.66
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.34
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

methyl 3-[2-cyclohexyl-1-(hydroxymethyl)cyclopropyl]benzoate
CID 67084618
(2-cyclohexyl-1-fluorocyclopropyl)methanol
CID 10419639
(1R)-2-ethyl-2-(4-fluorophenyl)cyclopropane-1-carboxylic acid
CID 105461613
[2-cyclobutyl-2-(4-fluorophenyl)cyclopropyl]methanol
CID 105475976
(3aS,4R,7aR)-4-(4-fluorophenyl)-1,2,3,3a,5,6,7,7a-octahydroisoindol-4-ol
CID 100876188
[6-cyclohexyl-1-(hydroxymethyl)cyclohex-3-en-1-yl]methanol
CID 139896226
1-cyclohexyl-4-fluorobenzene;phenylmethanol
CID 143134294
2-cyclohexyl-1-(4-fluorophenyl)ethanone
CID 12505091
2-cyclohexyl-1-(3-fluorophenyl)cyclohexan-1-ol
CID 60794928
5-[2-cyclopentyl-1-(hydroxymethyl)cyclopropyl]-N-[(dimethylamino)methyl]thiophene-2-sulfonamide
CID 69060598
(1R,5S)-8-[(1-cyclopentyltetrazol-5-yl)methyl]-3-(4-fluorophenyl)-8-azoniabicyclo[3.2.1]octan-3-ol
CID 7226903
trans-(1R,2S)-1-(4-bromophenyl)-2-cyclopentylcyclopropane-1-carboxylic acid
CID 101397995

Frequently Asked Questions

What is the IUPAC name of [2-cyclohexyl-1-(4-fluorophenyl)cyclopropyl]methanol?
The IUPAC name of [2-cyclohexyl-1-(4-fluorophenyl)cyclopropyl]methanol (CID 67084504) is [2-cyclohexyl-1-(4-fluorophenyl)cyclopropyl]methanol.
What is the SMILES notation for [2-cyclohexyl-1-(4-fluorophenyl)cyclopropyl]methanol?
The canonical SMILES for [2-cyclohexyl-1-(4-fluorophenyl)cyclopropyl]methanol is OCC1(c2ccc(F)cc2)CC1C1CCCCC1.
What is the InChIKey of [2-cyclohexyl-1-(4-fluorophenyl)cyclopropyl]methanol?
The InChIKey is PBKVOXONZHBADH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21FO/c17-14-8-6-13(7-9-14)16(11-18)10-15(16)12-4-2-1-3-5-12/h6-9,12,15,18H,1-5,10-11H2.
What are the key properties of [2-cyclohexyl-1-(4-fluorophenyl)cyclopropyl]methanol?
[2-cyclohexyl-1-(4-fluorophenyl)cyclopropyl]methanol has a molecular weight of 248.34 g/mol, XLogP of 3.66, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-cyclohexyl-1-(4-fluorophenyl)cyclopropyl]methanol is sourced from PubChem (CID 67084504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).