2-cyclopropyl-2-methyl-3-(2,2,2-trifluoroethoxy)propan-1-amine

C9H16F3NO — CID 106706192

IUPAC2-cyclopropyl-2-methyl-3-(2,2,2-trifluoroethoxy)propan-1-amine
SMILESCC(CN)(COCC(F)(F)F)C1CC1
InChIInChI=1S/C9H16F3NO/c1-8(4-13,7-2-3-7)5-14-6-9(10,11)12/h7H,2-6,13H2,1H3
InChIKeyARRJHUZJOYURAO-UHFFFAOYSA-N
MW211.23 g/mol
LogP1.94
Rot. Bonds5

About 2-cyclopropyl-2-methyl-3-(2,2,2-trifluoroethoxy)propan-1-amine

2-cyclopropyl-2-methyl-3-(2,2,2-trifluoroethoxy)propan-1-amine (PubChem CID 106706192) has the molecular formula C9H16F3NO and a molecular weight of 211.23 g/mol. Its IUPAC name is 2-cyclopropyl-2-methyl-3-(2,2,2-trifluoroethoxy)propan-1-amine.

Molecular Properties

Compound Name2-cyclopropyl-2-methyl-3-(2,2,2-trifluoroethoxy)propan-1-amine
PubChem CID106706192
Molecular FormulaC9H16F3NO
Molecular Weight211.23 g/mol
Exact Mass211.12
IUPAC Name2-cyclopropyl-2-methyl-3-(2,2,2-trifluoroethoxy)propan-1-amine
SMILESCC(CN)(COCC(F)(F)F)C1CC1
InChIInChI=1S/C9H16F3NO/c1-8(4-13,7-2-3-7)5-14-6-9(10,11)12/h7H,2-6,13H2,1H3
InChIKeyARRJHUZJOYURAO-UHFFFAOYSA-N
XLogP1.94
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.23
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-cyclopropyl-2-methyl-3-(2,2,2-trifluoroethoxy)propan-1-amine 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

2,2-Dimethyl-5-(2,2,2-trifluoroethoxy)pentan-1-amine
CID 62740828
5-(2,2-Difluoroethoxy)-2,2-dimethylpentan-1-amine
CID 82004327
2,2-Dimethyl-5-(4,4,4-trifluorobutoxy)pentan-1-amine
CID 82789398
2,2-Dimethyl-5-(3,3,3-trifluoropropoxy)pentan-1-amine
CID 82955014
3,3-Dimethyl-2-[2-(2,2,2-trifluoroethoxy)ethyl]butan-1-amine
CID 83138888
2-Cyclopropyl-2-methyl-4-(2,2,2-trifluoroethoxy)butan-1-amine
CID 83149354
2,3-Dimethyl-2-[2-(2,2,2-trifluoroethoxy)ethyl]butan-1-amine
CID 83160460
4-Methyl-2-(2,2,2-trifluoroethoxymethyl)pentan-1-amine
CID 106705851
2-(2,2,2-Trifluoroethoxymethyl)pentan-1-amine
CID 106705852
2-Methyl-2-(2,2,2-trifluoroethoxymethyl)pentan-1-amine
CID 106705973
2-cyclopropyl-N,2-dimethyl-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 106706193
2-cyclopropyl-N-ethyl-2-methyl-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 106706194

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-methyl-3-(2,2,2-trifluoroethoxy)propan-1-amine?
The IUPAC name of 2-cyclopropyl-2-methyl-3-(2,2,2-trifluoroethoxy)propan-1-amine (CID 106706192) is 2-cyclopropyl-2-methyl-3-(2,2,2-trifluoroethoxy)propan-1-amine.
What is the SMILES notation for 2-cyclopropyl-2-methyl-3-(2,2,2-trifluoroethoxy)propan-1-amine?
The canonical SMILES for 2-cyclopropyl-2-methyl-3-(2,2,2-trifluoroethoxy)propan-1-amine is CC(CN)(COCC(F)(F)F)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-methyl-3-(2,2,2-trifluoroethoxy)propan-1-amine?
The InChIKey is ARRJHUZJOYURAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16F3NO/c1-8(4-13,7-2-3-7)5-14-6-9(10,11)12/h7H,2-6,13H2,1H3.
What are the key properties of 2-cyclopropyl-2-methyl-3-(2,2,2-trifluoroethoxy)propan-1-amine?
2-cyclopropyl-2-methyl-3-(2,2,2-trifluoroethoxy)propan-1-amine has a molecular weight of 211.23 g/mol, XLogP of 1.94, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-methyl-3-(2,2,2-trifluoroethoxy)propan-1-amine is sourced from PubChem (CID 106706192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).