1-methoxy-3-[[2-(trifluoromethyl)cyclohexyl]amino]propan-2-ol

C11H20F3NO2 — CID 64758911

IUPAC1-methoxy-3-[[2-(trifluoromethyl)cyclohexyl]amino]propan-2-ol
SMILESCOCC(O)CNC1CCCCC1C(F)(F)F
InChIInChI=1S/C11H20F3NO2/c1-17-7-8(16)6-15-10-5-3-2-4-9(10)11(12,13)14/h8-10,15-16H,2-7H2,1H3
InChIKeyRTTZXTRCUPOZMV-UHFFFAOYSA-N
MW255.28 g/mol
LogP1.70
Rot. Bonds5

About 1-methoxy-3-[[2-(trifluoromethyl)cyclohexyl]amino]propan-2-ol

1-methoxy-3-[[2-(trifluoromethyl)cyclohexyl]amino]propan-2-ol (PubChem CID 64758911) has the molecular formula C11H20F3NO2 and a molecular weight of 255.28 g/mol. Its IUPAC name is 1-methoxy-3-[[2-(trifluoromethyl)cyclohexyl]amino]propan-2-ol.

Molecular Properties

Compound Name1-methoxy-3-[[2-(trifluoromethyl)cyclohexyl]amino]propan-2-ol
PubChem CID64758911
Molecular FormulaC11H20F3NO2
Molecular Weight255.28 g/mol
Exact Mass255.14
IUPAC Name1-methoxy-3-[[2-(trifluoromethyl)cyclohexyl]amino]propan-2-ol
SMILESCOCC(O)CNC1CCCCC1C(F)(F)F
InChIInChI=1S/C11H20F3NO2/c1-17-7-8(16)6-15-10-5-3-2-4-9(10)11(12,13)14/h8-10,15-16H,2-7H2,1H3
InChIKeyRTTZXTRCUPOZMV-UHFFFAOYSA-N
XLogP1.70
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,2-difluoroethyl)-2-(trifluoromethyl)cyclohexan-1-amine
CID 115406111
N-(2-methylpropyl)-2-(trifluoromethyl)cyclohexan-1-amine
CID 43434483
4-methoxy-2-[[2-(trifluoromethyl)cyclohexyl]amino]butan-1-ol
CID 114210492
N-[2-(2-methoxyethoxy)ethyl]-2-(trifluoromethyl)cyclohexan-1-amine
CID 64759706
N-(3-methylbut-2-enyl)-2-(trifluoromethyl)cyclohexan-1-amine
CID 104934180
1-(cyclopropylamino)-3-methoxypropan-2-ol
CID 21034992
1-methoxy-3-[(2-piperidin-2-ylcyclopentyl)amino]propan-2-ol
CID 79544808
N-(3-hydroxy-4-methoxybutyl)-2-(trifluoromethyl)cyclohexane-1-carboxamide
CID 103877346
1-[(2-ethylcyclohexyl)amino]-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 106989604
2-[[2-(trifluoromethyl)cyclohexyl]amino]ethanol
CID 64759490
N-propan-2-yl-2-[[2-(trifluoromethyl)cyclohexyl]amino]acetamide
CID 64758473
N'-methyl-N'-propan-2-yl-N-[2-(trifluoromethyl)cyclohexyl]propane-1,3-diamine
CID 106040935

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-3-[[2-(trifluoromethyl)cyclohexyl]amino]propan-2-ol?
The IUPAC name of 1-methoxy-3-[[2-(trifluoromethyl)cyclohexyl]amino]propan-2-ol (CID 64758911) is 1-methoxy-3-[[2-(trifluoromethyl)cyclohexyl]amino]propan-2-ol.
What is the SMILES notation for 1-methoxy-3-[[2-(trifluoromethyl)cyclohexyl]amino]propan-2-ol?
The canonical SMILES for 1-methoxy-3-[[2-(trifluoromethyl)cyclohexyl]amino]propan-2-ol is COCC(O)CNC1CCCCC1C(F)(F)F.
What is the InChIKey of 1-methoxy-3-[[2-(trifluoromethyl)cyclohexyl]amino]propan-2-ol?
The InChIKey is RTTZXTRCUPOZMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F3NO2/c1-17-7-8(16)6-15-10-5-3-2-4-9(10)11(12,13)14/h8-10,15-16H,2-7H2,1H3.
What are the key properties of 1-methoxy-3-[[2-(trifluoromethyl)cyclohexyl]amino]propan-2-ol?
1-methoxy-3-[[2-(trifluoromethyl)cyclohexyl]amino]propan-2-ol has a molecular weight of 255.28 g/mol, XLogP of 1.70, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-3-[[2-(trifluoromethyl)cyclohexyl]amino]propan-2-ol is sourced from PubChem (CID 64758911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).