2-methoxy-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine

C9H16F3NO — CID 43755109

IUPAC2-methoxy-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine
SMILESCOC1CCCCC1NCC(F)(F)F
InChIInChI=1S/C9H16F3NO/c1-14-8-5-3-2-4-7(8)13-6-9(10,11)12/h7-8,13H,2-6H2,1H3
InChIKeyMGPRYZLINCZDHO-UHFFFAOYSA-N
MW211.23 g/mol
LogP2.10
Rot. Bonds3

About 2-methoxy-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine

2-methoxy-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine (PubChem CID 43755109) has the molecular formula C9H16F3NO and a molecular weight of 211.23 g/mol. Its IUPAC name is 2-methoxy-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine.

Molecular Properties

Compound Name2-methoxy-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine
PubChem CID43755109
Molecular FormulaC9H16F3NO
Molecular Weight211.23 g/mol
Exact Mass211.12
IUPAC Name2-methoxy-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine
SMILESCOC1CCCCC1NCC(F)(F)F
InChIInChI=1S/C9H16F3NO/c1-14-8-5-3-2-4-7(8)13-6-9(10,11)12/h7-8,13H,2-6H2,1H3
InChIKeyMGPRYZLINCZDHO-UHFFFAOYSA-N
XLogP2.10
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.23
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-methoxy-N-(2,2,2-trifluoroethyl)cyclohexan-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

trans-(1S,2S)-N-ethyl-2-methoxycyclohexan-1-amine
CID 93280859
2-methoxy-N-[2-(trifluoromethylsulfanyl)ethyl]cyclohexan-1-amine
CID 106426795
N'-(2-methoxycyclohexyl)-N,N,2,2-tetramethylpropane-1,3-diamine
CID 43758942
N-(cyclopropylmethyl)-2-methoxycyclohexan-1-amine
CID 43756809
3-[(2-methoxycyclohexyl)amino]-2,2-dimethylpropanamide
CID 106274861
N-ethyl-2-methoxycyclopentan-1-amine
CID 53276122
2-methoxy-N-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]cyclohexan-1-amine
CID 60856324
3,3,3-trifluoro-2-[[(2-methoxycyclopentyl)amino]methyl]propanenitrile
CID 103367209
2-tert-butyl-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine
CID 43079272
cis-(1S,2R)-2-methoxy-N-(2-methylpropyl)cyclopentan-1-amine
CID 176752788
2-[[(1R,2R)-2-methoxycyclohexyl]amino]acetic acid
CID 93286937
2-methyl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine
CID 63278251

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine?
The IUPAC name of 2-methoxy-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine (CID 43755109) is 2-methoxy-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine.
What is the SMILES notation for 2-methoxy-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine?
The canonical SMILES for 2-methoxy-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine is COC1CCCCC1NCC(F)(F)F.
What is the InChIKey of 2-methoxy-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine?
The InChIKey is MGPRYZLINCZDHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16F3NO/c1-14-8-5-3-2-4-7(8)13-6-9(10,11)12/h7-8,13H,2-6H2,1H3.
What are the key properties of 2-methoxy-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine?
2-methoxy-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine has a molecular weight of 211.23 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine is sourced from PubChem (CID 43755109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).