1-cyclohexyl-2-[(4-fluorophenyl)methyl-methylamino]ethanol

C16H24FNO — CID 104752723

IUPAC1-cyclohexyl-2-[(4-fluorophenyl)methyl-methylamino]ethanol
SMILESCN(Cc1ccc(F)cc1)CC(O)C1CCCCC1
InChIInChI=1S/C16H24FNO/c1-18(11-13-7-9-15(17)10-8-13)12-16(19)14-5-3-2-4-6-14/h7-10,14,16,19H,2-6,11-12H2,1H3
InChIKeyXVMZSUUKSAYLTJ-UHFFFAOYSA-N
MW265.37 g/mol
LogP3.20
Rot. Bonds5

About 1-cyclohexyl-2-[(4-fluorophenyl)methyl-methylamino]ethanol

1-cyclohexyl-2-[(4-fluorophenyl)methyl-methylamino]ethanol (PubChem CID 104752723) has the molecular formula C16H24FNO and a molecular weight of 265.37 g/mol. Its IUPAC name is 1-cyclohexyl-2-[(4-fluorophenyl)methyl-methylamino]ethanol.

Molecular Properties

Compound Name1-cyclohexyl-2-[(4-fluorophenyl)methyl-methylamino]ethanol
PubChem CID104752723
Molecular FormulaC16H24FNO
Molecular Weight265.37 g/mol
Exact Mass265.18
IUPAC Name1-cyclohexyl-2-[(4-fluorophenyl)methyl-methylamino]ethanol
SMILESCN(Cc1ccc(F)cc1)CC(O)C1CCCCC1
InChIInChI=1S/C16H24FNO/c1-18(11-13-7-9-15(17)10-8-13)12-16(19)14-5-3-2-4-6-14/h7-10,14,16,19H,2-6,11-12H2,1H3
InChIKeyXVMZSUUKSAYLTJ-UHFFFAOYSA-N
XLogP3.20
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.37
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(4-chlorophenyl)methyl-methylamino]-1-cyclopropylethanol
CID 111858655
1-cyclopropyl-2-[(3-fluorophenyl)methyl-methylamino]ethanol
CID 111858608
1-cyclohexyl-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]ethanol
CID 104752674
1-cyclopropyl-2-[(2,4-difluorophenyl)methyl-methylamino]ethanol
CID 111977227
4-[[(2-cyclopropyl-2-hydroxyethyl)-methylamino]methyl]benzamide
CID 111858640
1-cyclopropyl-2-[2-(4-fluorophenyl)sulfanylethyl-methylamino]ethanol
CID 111858759
1-chloro-3-[(4-fluorophenyl)methyl-methylamino]propan-2-ol
CID 112561328
1-cyclopentyl-2-[(4-fluorophenyl)methylamino]ethanol
CID 111425447
1-cyclohexyl-N,N'-dimethyl-N'-(pyridin-4-ylmethyl)ethane-1,2-diamine
CID 104744827
2-[(2-cyclopropyl-2-hydroxyethyl)-methylamino]-N-[1-(4-fluorophenyl)ethyl]-N-methylacetamide
CID 111858821
1-cyclopropyl-2-(N-ethyl-4-fluoroanilino)ethanol
CID 63908117
N-cyclohexyl-2-[[2-(4-fluorophenyl)acetyl]-[(4-fluorophenyl)methyl]amino]propanamide
CID 132984690

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-[(4-fluorophenyl)methyl-methylamino]ethanol?
The IUPAC name of 1-cyclohexyl-2-[(4-fluorophenyl)methyl-methylamino]ethanol (CID 104752723) is 1-cyclohexyl-2-[(4-fluorophenyl)methyl-methylamino]ethanol.
What is the SMILES notation for 1-cyclohexyl-2-[(4-fluorophenyl)methyl-methylamino]ethanol?
The canonical SMILES for 1-cyclohexyl-2-[(4-fluorophenyl)methyl-methylamino]ethanol is CN(Cc1ccc(F)cc1)CC(O)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-2-[(4-fluorophenyl)methyl-methylamino]ethanol?
The InChIKey is XVMZSUUKSAYLTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FNO/c1-18(11-13-7-9-15(17)10-8-13)12-16(19)14-5-3-2-4-6-14/h7-10,14,16,19H,2-6,11-12H2,1H3.
What are the key properties of 1-cyclohexyl-2-[(4-fluorophenyl)methyl-methylamino]ethanol?
1-cyclohexyl-2-[(4-fluorophenyl)methyl-methylamino]ethanol has a molecular weight of 265.37 g/mol, XLogP of 3.20, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-[(4-fluorophenyl)methyl-methylamino]ethanol is sourced from PubChem (CID 104752723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).