2-cyclopropyl-N-[3-(trifluoromethyl)cyclohexyl]oxolan-3-amine

C14H22F3NO — CID 102613100

IUPAC2-cyclopropyl-N-[3-(trifluoromethyl)cyclohexyl]oxolan-3-amine
SMILESFC(F)(F)C1CCCC(NC2CCOC2C2CC2)C1
InChIInChI=1S/C14H22F3NO/c15-14(16,17)10-2-1-3-11(8-10)18-12-6-7-19-13(12)9-4-5-9/h9-13,18H,1-8H2
InChIKeyXRHBQCYTMLUWMG-UHFFFAOYSA-N
MW277.33 g/mol
LogP3.26
Rot. Bonds3

About 2-cyclopropyl-N-[3-(trifluoromethyl)cyclohexyl]oxolan-3-amine

2-cyclopropyl-N-[3-(trifluoromethyl)cyclohexyl]oxolan-3-amine (PubChem CID 102613100) has the molecular formula C14H22F3NO and a molecular weight of 277.33 g/mol. Its IUPAC name is 2-cyclopropyl-N-[3-(trifluoromethyl)cyclohexyl]oxolan-3-amine.

Molecular Properties

Compound Name2-cyclopropyl-N-[3-(trifluoromethyl)cyclohexyl]oxolan-3-amine
PubChem CID102613100
Molecular FormulaC14H22F3NO
Molecular Weight277.33 g/mol
Exact Mass277.17
IUPAC Name2-cyclopropyl-N-[3-(trifluoromethyl)cyclohexyl]oxolan-3-amine
SMILESFC(F)(F)C1CCCC(NC2CCOC2C2CC2)C1
InChIInChI=1S/C14H22F3NO/c15-14(16,17)10-2-1-3-11(8-10)18-12-6-7-19-13(12)9-4-5-9/h9-13,18H,1-8H2
InChIKeyXRHBQCYTMLUWMG-UHFFFAOYSA-N
XLogP3.26
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

trans-(1R,3R)-3-(trifluoromethyl)-N-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine
CID 39870295
N-[3-(trifluoromethyl)cyclohexyl]-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine
CID 43434428
N-(2-cyclopropyloxolan-3-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 103914619
[(1R,3S)-3-(trifluoromethyl)cyclohexyl]hydrazine
CID 124506889
3,4-dimethyl-N-[3-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine
CID 64746000
N-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]morpholine-4-sulfonamide
CID 95266419
1,2,5-trimethyl-N-[3-(trifluoromethyl)cyclohexyl]piperidin-4-amine
CID 43747487
N-[3-(trifluoromethyl)cyclohexyl]pyrrolidin-3-amine
CID 79731027
1-methylsulfonyl-N-[3-(trifluoromethyl)cyclohexyl]piperidin-4-amine
CID 64757172
N-cyclohex-2-en-1-yl-2-cyclopropyloxolan-3-amine
CID 103580766
cis-(1S,3R)-N-[(2-methyl-1,3-dioxolan-2-yl)methyl]-3-(trifluoromethyl)cyclohexan-1-amine
CID 99827879
N-(3-phenylcyclobutyl)-3-(trifluoromethyl)cyclohexan-1-amine
CID 43747481

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-[3-(trifluoromethyl)cyclohexyl]oxolan-3-amine?
The IUPAC name of 2-cyclopropyl-N-[3-(trifluoromethyl)cyclohexyl]oxolan-3-amine (CID 102613100) is 2-cyclopropyl-N-[3-(trifluoromethyl)cyclohexyl]oxolan-3-amine.
What is the SMILES notation for 2-cyclopropyl-N-[3-(trifluoromethyl)cyclohexyl]oxolan-3-amine?
The canonical SMILES for 2-cyclopropyl-N-[3-(trifluoromethyl)cyclohexyl]oxolan-3-amine is FC(F)(F)C1CCCC(NC2CCOC2C2CC2)C1.
What is the InChIKey of 2-cyclopropyl-N-[3-(trifluoromethyl)cyclohexyl]oxolan-3-amine?
The InChIKey is XRHBQCYTMLUWMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22F3NO/c15-14(16,17)10-2-1-3-11(8-10)18-12-6-7-19-13(12)9-4-5-9/h9-13,18H,1-8H2.
What are the key properties of 2-cyclopropyl-N-[3-(trifluoromethyl)cyclohexyl]oxolan-3-amine?
2-cyclopropyl-N-[3-(trifluoromethyl)cyclohexyl]oxolan-3-amine has a molecular weight of 277.33 g/mol, XLogP of 3.26, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-[3-(trifluoromethyl)cyclohexyl]oxolan-3-amine is sourced from PubChem (CID 102613100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).