1-(furan-2-yl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]methanamine

C13H18F3NO — CID 105147062

IUPAC1-(furan-2-yl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]methanamine
SMILESCNC(c1ccco1)C1CCCCC1C(F)(F)F
InChIInChI=1S/C13H18F3NO/c1-17-12(11-7-4-8-18-11)9-5-2-3-6-10(9)13(14,15)16/h4,7-10,12,17H,2-3,5-6H2,1H3
InChIKeyCUPBGFOEVGWHDK-UHFFFAOYSA-N
MW261.29 g/mol
LogP3.91
Rot. Bonds3

About 1-(furan-2-yl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]methanamine

1-(furan-2-yl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]methanamine (PubChem CID 105147062) has the molecular formula C13H18F3NO and a molecular weight of 261.29 g/mol. Its IUPAC name is 1-(furan-2-yl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]methanamine.

Molecular Properties

Compound Name1-(furan-2-yl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]methanamine
PubChem CID105147062
Molecular FormulaC13H18F3NO
Molecular Weight261.29 g/mol
Exact Mass261.13
IUPAC Name1-(furan-2-yl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]methanamine
SMILESCNC(c1ccco1)C1CCCCC1C(F)(F)F
InChIInChI=1S/C13H18F3NO/c1-17-12(11-7-4-8-18-11)9-5-2-3-6-10(9)13(14,15)16/h4,7-10,12,17H,2-3,5-6H2,1H3
InChIKeyCUPBGFOEVGWHDK-UHFFFAOYSA-N
XLogP3.91
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.29
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(furan-2-yl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]methanamine 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

N-methyl-1-(3-methylphenyl)-1-[2-(trifluoromethyl)cyclohexyl]methanamine
CID 105090899
1-(3,4-dimethylphenyl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]methanamine
CID 105140403
1-(4,4-difluorocyclohexyl)-1-(furan-2-yl)-N-methylmethanamine
CID 105147024
1-(3,4-dihydro-2H-pyran-5-yl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]methanamine
CID 105179436
1-(2,4-dimethylphenyl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]methanamine
CID 105145370
1-(furan-2-yl)-N-methyl-1-(3-oxabicyclo[3.1.0]hexan-6-yl)methanamine
CID 131204430
cis-(1S,2R)-N-[(2S)-2-(furan-2-yl)-2-hydroxyethyl]-2-(trifluoromethyl)cyclohexane-1-carboxamide
CID 98793149
trans-(1R,2R)-N-[(2S)-2-(furan-2-yl)-2-hydroxyethyl]-2-(trifluoromethyl)cyclohexane-1-carboxamide
CID 98793148
2-(2-fluorophenyl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine
CID 104622284
[furan-2-yl-(2-methylcyclopentyl)methyl]hydrazine
CID 107193917
N-[phenyl-[2-(trifluoromethyl)cyclohexyl]methyl]propan-1-amine
CID 105084116
N-[1-(furan-2-yl)ethyl]-4-(trifluoromethyl)cyclohexan-1-amine
CID 43730440

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]methanamine?
The IUPAC name of 1-(furan-2-yl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]methanamine (CID 105147062) is 1-(furan-2-yl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]methanamine.
What is the SMILES notation for 1-(furan-2-yl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]methanamine?
The canonical SMILES for 1-(furan-2-yl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]methanamine is CNC(c1ccco1)C1CCCCC1C(F)(F)F.
What is the InChIKey of 1-(furan-2-yl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]methanamine?
The InChIKey is CUPBGFOEVGWHDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18F3NO/c1-17-12(11-7-4-8-18-11)9-5-2-3-6-10(9)13(14,15)16/h4,7-10,12,17H,2-3,5-6H2,1H3.
What are the key properties of 1-(furan-2-yl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]methanamine?
1-(furan-2-yl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]methanamine has a molecular weight of 261.29 g/mol, XLogP of 3.91, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]methanamine is sourced from PubChem (CID 105147062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).