3-(cyclopropylamino)-1-(trifluoromethyl)cyclohexan-1-ol

C10H16F3NO — CID 83917869

IUPAC3-(cyclopropylamino)-1-(trifluoromethyl)cyclohexan-1-ol
SMILESOC1(C(F)(F)F)CCCC(NC2CC2)C1
InChIInChI=1S/C10H16F3NO/c11-10(12,13)9(15)5-1-2-8(6-9)14-7-3-4-7/h7-8,14-15H,1-6H2
InChIKeyMAUUVIAHCQPTAH-UHFFFAOYSA-N
MW223.24 g/mol
LogP1.97
Rot. Bonds2

About 3-(cyclopropylamino)-1-(trifluoromethyl)cyclohexan-1-ol

3-(cyclopropylamino)-1-(trifluoromethyl)cyclohexan-1-ol (PubChem CID 83917869) has the molecular formula C10H16F3NO and a molecular weight of 223.24 g/mol. Its IUPAC name is 3-(cyclopropylamino)-1-(trifluoromethyl)cyclohexan-1-ol.

Molecular Properties

Compound Name3-(cyclopropylamino)-1-(trifluoromethyl)cyclohexan-1-ol
PubChem CID83917869
Molecular FormulaC10H16F3NO
Molecular Weight223.24 g/mol
Exact Mass223.12
IUPAC Name3-(cyclopropylamino)-1-(trifluoromethyl)cyclohexan-1-ol
SMILESOC1(C(F)(F)F)CCCC(NC2CC2)C1
InChIInChI=1S/C10H16F3NO/c11-10(12,13)9(15)5-1-2-8(6-9)14-7-3-4-7/h7-8,14-15H,1-6H2
InChIKeyMAUUVIAHCQPTAH-UHFFFAOYSA-N
XLogP1.97
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.24
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylamino)-1-(trifluoromethyl)cyclohexan-1-ol?
The IUPAC name of 3-(cyclopropylamino)-1-(trifluoromethyl)cyclohexan-1-ol (CID 83917869) is 3-(cyclopropylamino)-1-(trifluoromethyl)cyclohexan-1-ol.
What is the SMILES notation for 3-(cyclopropylamino)-1-(trifluoromethyl)cyclohexan-1-ol?
The canonical SMILES for 3-(cyclopropylamino)-1-(trifluoromethyl)cyclohexan-1-ol is OC1(C(F)(F)F)CCCC(NC2CC2)C1.
What is the InChIKey of 3-(cyclopropylamino)-1-(trifluoromethyl)cyclohexan-1-ol?
The InChIKey is MAUUVIAHCQPTAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F3NO/c11-10(12,13)9(15)5-1-2-8(6-9)14-7-3-4-7/h7-8,14-15H,1-6H2.
What are the key properties of 3-(cyclopropylamino)-1-(trifluoromethyl)cyclohexan-1-ol?
3-(cyclopropylamino)-1-(trifluoromethyl)cyclohexan-1-ol has a molecular weight of 223.24 g/mol, XLogP of 1.97, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylamino)-1-(trifluoromethyl)cyclohexan-1-ol is sourced from PubChem (CID 83917869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).