3-(2-methylpentan-2-ylamino)-1-(trifluoromethyl)cyclobutan-1-ol

C11H20F3NO — CID 138581103

IUPAC3-(2-methylpentan-2-ylamino)-1-(trifluoromethyl)cyclobutan-1-ol
SMILESCCCC(C)(C)NC1CC(O)(C(F)(F)F)C1
InChIInChI=1S/C11H20F3NO/c1-4-5-9(2,3)15-8-6-10(16,7-8)11(12,13)14/h8,15-16H,4-7H2,1-3H3
InChIKeyHLEWUXVXMBEGBP-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.61
Rot. Bonds4

About 3-(2-methylpentan-2-ylamino)-1-(trifluoromethyl)cyclobutan-1-ol

3-(2-methylpentan-2-ylamino)-1-(trifluoromethyl)cyclobutan-1-ol (PubChem CID 138581103) has the molecular formula C11H20F3NO and a molecular weight of 239.28 g/mol. Its IUPAC name is 3-(2-methylpentan-2-ylamino)-1-(trifluoromethyl)cyclobutan-1-ol.

Molecular Properties

Compound Name3-(2-methylpentan-2-ylamino)-1-(trifluoromethyl)cyclobutan-1-ol
PubChem CID138581103
Molecular FormulaC11H20F3NO
Molecular Weight239.28 g/mol
Exact Mass239.15
IUPAC Name3-(2-methylpentan-2-ylamino)-1-(trifluoromethyl)cyclobutan-1-ol
SMILESCCCC(C)(C)NC1CC(O)(C(F)(F)F)C1
InChIInChI=1S/C11H20F3NO/c1-4-5-9(2,3)15-8-6-10(16,7-8)11(12,13)14/h8,15-16H,4-7H2,1-3H3
InChIKeyHLEWUXVXMBEGBP-UHFFFAOYSA-N
XLogP2.61
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-(2-methylpentan-2-ylamino)-1-(trifluoromethyl)cyclobutan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,1,1-Trifluoro-4-(methylamino)-2-(trifluoromethyl)pentan-2-ol
CID 101772932
1,1,1-Trifluoro-2-methyl-4-(methylamino)pentan-2-ol
CID 117736611
3-(Tert-butylamino)-1-(trifluoromethyl)cyclobutan-1-ol
CID 134166297
3-(Methylamino)-1-(trifluoromethyl)cyclobutan-1-ol
CID 134367353
1-(Fluoromethyl)-3-(2-methylpropylamino)cyclobutan-1-ol
CID 146297203
3-(Ethylamino)-1-(fluoromethyl)cyclobutan-1-ol
CID 170133384
5,5,5-Trifluoro-2-methyl-4-(methylamino)pentan-2-ol
CID 178143366
6,6,6-Trifluoro-3-methyl-1-(propan-2-ylamino)hexan-3-ol
CID 65984806
1-(Tert-butylamino)-6,6,6-trifluoro-3-methylhexan-3-ol
CID 66001874
5,5,5-Trifluoro-2-methyl-1-(propan-2-ylamino)pentan-2-ol
CID 66037252
1-(Tert-butylamino)-5,5,5-trifluoro-2-methylpentan-2-ol
CID 66038219
1,1,1-Trifluoro-2-methyl-4-(propan-2-ylamino)butan-2-ol
CID 80558961

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylpentan-2-ylamino)-1-(trifluoromethyl)cyclobutan-1-ol?
The IUPAC name of 3-(2-methylpentan-2-ylamino)-1-(trifluoromethyl)cyclobutan-1-ol (CID 138581103) is 3-(2-methylpentan-2-ylamino)-1-(trifluoromethyl)cyclobutan-1-ol.
What is the SMILES notation for 3-(2-methylpentan-2-ylamino)-1-(trifluoromethyl)cyclobutan-1-ol?
The canonical SMILES for 3-(2-methylpentan-2-ylamino)-1-(trifluoromethyl)cyclobutan-1-ol is CCCC(C)(C)NC1CC(O)(C(F)(F)F)C1.
What is the InChIKey of 3-(2-methylpentan-2-ylamino)-1-(trifluoromethyl)cyclobutan-1-ol?
The InChIKey is HLEWUXVXMBEGBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F3NO/c1-4-5-9(2,3)15-8-6-10(16,7-8)11(12,13)14/h8,15-16H,4-7H2,1-3H3.
What are the key properties of 3-(2-methylpentan-2-ylamino)-1-(trifluoromethyl)cyclobutan-1-ol?
3-(2-methylpentan-2-ylamino)-1-(trifluoromethyl)cyclobutan-1-ol has a molecular weight of 239.28 g/mol, XLogP of 2.61, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylpentan-2-ylamino)-1-(trifluoromethyl)cyclobutan-1-ol is sourced from PubChem (CID 138581103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).