N-[4-(trifluoromethyl)cyclohexyl]oxolan-3-amine

C11H18F3NO — CID 63335517

IUPACN-[4-(trifluoromethyl)cyclohexyl]oxolan-3-amine
SMILESFC(F)(F)C1CCC(NC2CCOC2)CC1
InChIInChI=1S/C11H18F3NO/c12-11(13,14)8-1-3-9(4-2-8)15-10-5-6-16-7-10/h8-10,15H,1-7H2
InChIKeyMNKNOABNZBTHKK-UHFFFAOYSA-N
MW237.26 g/mol
LogP2.49
Rot. Bonds2

About N-[4-(trifluoromethyl)cyclohexyl]oxolan-3-amine

N-[4-(trifluoromethyl)cyclohexyl]oxolan-3-amine (PubChem CID 63335517) has the molecular formula C11H18F3NO and a molecular weight of 237.26 g/mol. Its IUPAC name is N-[4-(trifluoromethyl)cyclohexyl]oxolan-3-amine.

Molecular Properties

Compound NameN-[4-(trifluoromethyl)cyclohexyl]oxolan-3-amine
PubChem CID63335517
Molecular FormulaC11H18F3NO
Molecular Weight237.26 g/mol
Exact Mass237.13
IUPAC NameN-[4-(trifluoromethyl)cyclohexyl]oxolan-3-amine
SMILESFC(F)(F)C1CCC(NC2CCOC2)CC1
InChIInChI=1S/C11H18F3NO/c12-11(13,14)8-1-3-9(4-2-8)15-10-5-6-16-7-10/h8-10,15H,1-7H2
InChIKeyMNKNOABNZBTHKK-UHFFFAOYSA-N
XLogP2.49
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopentyloxolan-3-amine
CID 63331713
(3R)-N-cyclohexyloxolan-3-amine;hydrochloride
CID 166178208
4-tert-butyl-N-[4-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine
CID 43434650
N-(1-oxothian-4-yl)oxolan-3-amine
CID 80717719
N-[4-[(dimethylamino)methyl]cyclohexyl]oxolan-3-amine
CID 115752858
1,1-dioxo-N-[4-(trifluoromethyl)cyclohexyl]thian-3-amine
CID 63923212
N-cycloheptyloxan-3-amine
CID 63359772
oxolan-3-yl-[4-(trifluoromethyl)cyclohexyl]methanone
CID 105099768
N-[(3R)-oxolan-3-yl]-1-propan-2-ylpiperidin-4-amine
CID 178157179
1-methyl-N-(oxolan-3-yl)azepan-4-amine
CID 80712996
N-[(3R)-oxolan-3-yl]hydroxylamine
CID 124574155
N-cyclopentyloxan-4-amine
CID 28694035

Frequently Asked Questions

What is the IUPAC name of N-[4-(trifluoromethyl)cyclohexyl]oxolan-3-amine?
The IUPAC name of N-[4-(trifluoromethyl)cyclohexyl]oxolan-3-amine (CID 63335517) is N-[4-(trifluoromethyl)cyclohexyl]oxolan-3-amine.
What is the SMILES notation for N-[4-(trifluoromethyl)cyclohexyl]oxolan-3-amine?
The canonical SMILES for N-[4-(trifluoromethyl)cyclohexyl]oxolan-3-amine is FC(F)(F)C1CCC(NC2CCOC2)CC1.
What is the InChIKey of N-[4-(trifluoromethyl)cyclohexyl]oxolan-3-amine?
The InChIKey is MNKNOABNZBTHKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18F3NO/c12-11(13,14)8-1-3-9(4-2-8)15-10-5-6-16-7-10/h8-10,15H,1-7H2.
What are the key properties of N-[4-(trifluoromethyl)cyclohexyl]oxolan-3-amine?
N-[4-(trifluoromethyl)cyclohexyl]oxolan-3-amine has a molecular weight of 237.26 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(trifluoromethyl)cyclohexyl]oxolan-3-amine is sourced from PubChem (CID 63335517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).