[1-[4-(trifluoromethyl)anilino]cyclohexyl]methanol

C14H18F3NO — CID 62649108

IUPAC[1-[4-(trifluoromethyl)anilino]cyclohexyl]methanol
SMILESOCC1(Nc2ccc(C(F)(F)F)cc2)CCCCC1
InChIInChI=1S/C14H18F3NO/c15-14(16,17)11-4-6-12(7-5-11)18-13(10-19)8-2-1-3-9-13/h4-7,18-19H,1-3,8-10H2
InChIKeyHFXDHCQJARVVNR-UHFFFAOYSA-N
MW273.30 g/mol
LogP3.81
Rot. Bonds3

About [1-[4-(trifluoromethyl)anilino]cyclohexyl]methanol

[1-[4-(trifluoromethyl)anilino]cyclohexyl]methanol (PubChem CID 62649108) has the molecular formula C14H18F3NO and a molecular weight of 273.30 g/mol. Its IUPAC name is [1-[4-(trifluoromethyl)anilino]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[4-(trifluoromethyl)anilino]cyclohexyl]methanol
PubChem CID62649108
Molecular FormulaC14H18F3NO
Molecular Weight273.30 g/mol
Exact Mass273.13
IUPAC Name[1-[4-(trifluoromethyl)anilino]cyclohexyl]methanol
SMILESOCC1(Nc2ccc(C(F)(F)F)cc2)CCCCC1
InChIInChI=1S/C14H18F3NO/c15-14(16,17)11-4-6-12(7-5-11)18-13(10-19)8-2-1-3-9-13/h4-7,18-19H,1-3,8-10H2
InChIKeyHFXDHCQJARVVNR-UHFFFAOYSA-N
XLogP3.81
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.30
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(4-methylanilino)cycloheptyl]methanol
CID 61044779
[1-[4-amino-3-(trifluoromethyl)anilino]cyclohexyl]methanol
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[1-(4-nitroanilino)cyclohexyl]methanol
CID 62520982
[1-[4-(difluoromethylsulfonyl)anilino]cyclohexyl]methanol
CID 62519924
[1-[4-nitro-3-(trifluoromethyl)anilino]cyclopentyl]methanol
CID 11472201
[1-(4-nitroanilino)cyclopentyl]methanol
CID 59683301
[1-(4-methylsulfonylanilino)cyclopentyl]methanol
CID 55082586
[1-[[6-(trifluoromethyl)-2-pyridinyl]amino]cyclohexyl]methanol
CID 62520440
4-(aminomethyl)-N-[4-(trifluoromethyl)phenyl]oxan-4-amine
CID 106298388
[1-(4-propylsulfonylanilino)cyclohexyl]methanol
CID 62520983
[1-[[6-hydrazinyl-4-(trifluoromethyl)-2-pyridinyl]amino]cyclopentyl]methanol
CID 102720689
[8-(4-methylanilino)spiro[4.5]decan-8-yl]methanol
CID 114819821

Frequently Asked Questions

What is the IUPAC name of [1-[4-(trifluoromethyl)anilino]cyclohexyl]methanol?
The IUPAC name of [1-[4-(trifluoromethyl)anilino]cyclohexyl]methanol (CID 62649108) is [1-[4-(trifluoromethyl)anilino]cyclohexyl]methanol.
What is the SMILES notation for [1-[4-(trifluoromethyl)anilino]cyclohexyl]methanol?
The canonical SMILES for [1-[4-(trifluoromethyl)anilino]cyclohexyl]methanol is OCC1(Nc2ccc(C(F)(F)F)cc2)CCCCC1.
What is the InChIKey of [1-[4-(trifluoromethyl)anilino]cyclohexyl]methanol?
The InChIKey is HFXDHCQJARVVNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F3NO/c15-14(16,17)11-4-6-12(7-5-11)18-13(10-19)8-2-1-3-9-13/h4-7,18-19H,1-3,8-10H2.
What are the key properties of [1-[4-(trifluoromethyl)anilino]cyclohexyl]methanol?
[1-[4-(trifluoromethyl)anilino]cyclohexyl]methanol has a molecular weight of 273.30 g/mol, XLogP of 3.81, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[4-(trifluoromethyl)anilino]cyclohexyl]methanol is sourced from PubChem (CID 62649108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).