[2-cyclobutyl-2-(4-fluorophenyl)cyclopropyl]methanol

C14H17FO — CID 105475976

IUPAC[2-cyclobutyl-2-(4-fluorophenyl)cyclopropyl]methanol
SMILESOCC1CC1(c1ccc(F)cc1)C1CCC1
InChIInChI=1S/C14H17FO/c15-13-6-4-11(5-7-13)14(8-12(14)9-16)10-2-1-3-10/h4-7,10,12,16H,1-3,8-9H2
InChIKeyLBWOZAJWVPRDDU-UHFFFAOYSA-N
MW220.29 g/mol
LogP2.88
Rot. Bonds3

About [2-cyclobutyl-2-(4-fluorophenyl)cyclopropyl]methanol

[2-cyclobutyl-2-(4-fluorophenyl)cyclopropyl]methanol (PubChem CID 105475976) has the molecular formula C14H17FO and a molecular weight of 220.29 g/mol. Its IUPAC name is [2-cyclobutyl-2-(4-fluorophenyl)cyclopropyl]methanol.

Molecular Properties

Compound Name[2-cyclobutyl-2-(4-fluorophenyl)cyclopropyl]methanol
PubChem CID105475976
Molecular FormulaC14H17FO
Molecular Weight220.29 g/mol
Exact Mass220.13
IUPAC Name[2-cyclobutyl-2-(4-fluorophenyl)cyclopropyl]methanol
SMILESOCC1CC1(c1ccc(F)cc1)C1CCC1
InChIInChI=1S/C14H17FO/c15-13-6-4-11(5-7-13)14(8-12(14)9-16)10-2-1-3-10/h4-7,10,12,16H,1-3,8-9H2
InChIKeyLBWOZAJWVPRDDU-UHFFFAOYSA-N
XLogP2.88
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.29
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[2-cyclopropyl-2-(3-fluorophenyl)cyclopropyl]methanol
CID 105458990
2-[9-(4-fluorophenyl)-3-hydroxy-3-methyl-9-bicyclo[3.3.1]nonanyl]acetic acid
CID 59336884
[2-cyclohexyl-1-(4-fluorophenyl)cyclopropyl]methanol
CID 67084504
(2S)-N-[[1-(4-fluorophenyl)cyclopentyl]methyl]-2-(hydroxymethyl)pyrrolidine-1-carboxamide
CID 111427973
cis-(1S,2R)-1-(4-fluorophenyl)-2-(hydroxymethyl)cyclopropane-1-carboxylic acid;1-(4-fluorophenyl)-N-methylmethanamine
CID 172721238
cis-(1S,2R)-2-(4-fluorophenyl)-2-methylcyclopropan-1-amine
CID 94419746
(4-fluorophenyl)-[(2S)-2-(hydroxymethyl)piperidin-1-yl]methanone
CID 40620751
N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-3-(hydroxymethyl)pyrrolidine-1-carboxamide
CID 111443732
1-(4-fluorophenyl)-2-[2-(hydroxymethyl)piperidin-1-yl]propan-1-one
CID 62037342
6-[(4-fluorophenyl)methyl]bicyclo[3.1.0]hexan-6-ol
CID 79331044
trans-(1S,2S)-2-(N-ethyl-4-fluoroanilino)cyclopentan-1-ol
CID 102734657
[2-(3-fluorophenyl)-2-methylcyclopropyl]methanol
CID 81358099

Frequently Asked Questions

What is the IUPAC name of [2-cyclobutyl-2-(4-fluorophenyl)cyclopropyl]methanol?
The IUPAC name of [2-cyclobutyl-2-(4-fluorophenyl)cyclopropyl]methanol (CID 105475976) is [2-cyclobutyl-2-(4-fluorophenyl)cyclopropyl]methanol.
What is the SMILES notation for [2-cyclobutyl-2-(4-fluorophenyl)cyclopropyl]methanol?
The canonical SMILES for [2-cyclobutyl-2-(4-fluorophenyl)cyclopropyl]methanol is OCC1CC1(c1ccc(F)cc1)C1CCC1.
What is the InChIKey of [2-cyclobutyl-2-(4-fluorophenyl)cyclopropyl]methanol?
The InChIKey is LBWOZAJWVPRDDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FO/c15-13-6-4-11(5-7-13)14(8-12(14)9-16)10-2-1-3-10/h4-7,10,12,16H,1-3,8-9H2.
What are the key properties of [2-cyclobutyl-2-(4-fluorophenyl)cyclopropyl]methanol?
[2-cyclobutyl-2-(4-fluorophenyl)cyclopropyl]methanol has a molecular weight of 220.29 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-cyclobutyl-2-(4-fluorophenyl)cyclopropyl]methanol is sourced from PubChem (CID 105475976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).