2,2-dimethyl-6-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-N-propylcyclohexan-1-amine

C15H29F3N2 — CID 79853529

IUPAC2,2-dimethyl-6-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-N-propylcyclohexan-1-amine
SMILESCCCNC1C(CN(C)CC(F)(F)F)CCCC1(C)C
InChIInChI=1S/C15H29F3N2/c1-5-9-19-13-12(7-6-8-14(13,2)3)10-20(4)11-15(16,17)18/h12-13,19H,5-11H2,1-4H3
InChIKeyRKUHPLQJLYXFHC-UHFFFAOYSA-N
MW294.40 g/mol
LogP3.67
Rot. Bonds6

About 2,2-dimethyl-6-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-N-propylcyclohexan-1-amine

2,2-dimethyl-6-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-N-propylcyclohexan-1-amine (PubChem CID 79853529) has the molecular formula C15H29F3N2 and a molecular weight of 294.40 g/mol. Its IUPAC name is 2,2-dimethyl-6-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-N-propylcyclohexan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-6-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-N-propylcyclohexan-1-amine
PubChem CID79853529
Molecular FormulaC15H29F3N2
Molecular Weight294.40 g/mol
Exact Mass294.23
IUPAC Name2,2-dimethyl-6-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-N-propylcyclohexan-1-amine
SMILESCCCNC1C(CN(C)CC(F)(F)F)CCCC1(C)C
InChIInChI=1S/C15H29F3N2/c1-5-9-19-13-12(7-6-8-14(13,2)3)10-20(4)11-15(16,17)18/h12-13,19H,5-11H2,1-4H3
InChIKeyRKUHPLQJLYXFHC-UHFFFAOYSA-N
XLogP3.67
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,2-dimethyl-6-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-N-propylcyclohexan-1-amine with MolForge

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Related Compounds

N'-[[3,3-dimethyl-2-(propylamino)cyclohexyl]methyl]-N,N,N'-trimethylethane-1,2-diamine
CID 79849117
5-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-2,2-dimethyl-N-propylcyclopentan-1-amine
CID 79867191
3,3-dimethyl-1-N-propan-2-yl-2-N-propyl-1-N-(2,2,2-trifluoroethyl)cyclohexane-1,2-diamine
CID 79836033
N-ethyl-6-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-2,2-dimethylcyclohexan-1-amine
CID 79853442
6-[[cyclopropyl(propyl)amino]methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine
CID 79853092
5-[[cyclopentylmethyl(methyl)amino]methyl]-2,2-dimethyl-N-propylcyclopentan-1-amine
CID 79855876
6-[[cyclopropyl(cyclopropylmethyl)amino]methyl]-2,2-dimethyl-N-propylcyclohexan-1-amine
CID 79843316
6-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-N,2,2-trimethylcyclohexan-1-amine
CID 79852225
N-ethyl-2,2-dimethyl-6-[[methyl(2-methylpropyl)amino]methyl]cyclohexan-1-amine
CID 79852388
1-[[3,3-dimethyl-2-(propylamino)cyclopentyl]methyl-methylamino]propan-2-ol
CID 79855488
N-ethyl-2,2-dimethyl-6-[[methyl(2-methylbutyl)amino]methyl]cyclohexan-1-amine
CID 79853433
N-ethyl-2-[[methyl(2,2,2-trifluoroethyl)amino]methyl]cycloheptan-1-amine
CID 62615233

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-6-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-N-propylcyclohexan-1-amine?
The IUPAC name of 2,2-dimethyl-6-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-N-propylcyclohexan-1-amine (CID 79853529) is 2,2-dimethyl-6-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-N-propylcyclohexan-1-amine.
What is the SMILES notation for 2,2-dimethyl-6-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-N-propylcyclohexan-1-amine?
The canonical SMILES for 2,2-dimethyl-6-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-N-propylcyclohexan-1-amine is CCCNC1C(CN(C)CC(F)(F)F)CCCC1(C)C.
What is the InChIKey of 2,2-dimethyl-6-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-N-propylcyclohexan-1-amine?
The InChIKey is RKUHPLQJLYXFHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29F3N2/c1-5-9-19-13-12(7-6-8-14(13,2)3)10-20(4)11-15(16,17)18/h12-13,19H,5-11H2,1-4H3.
What are the key properties of 2,2-dimethyl-6-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-N-propylcyclohexan-1-amine?
2,2-dimethyl-6-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-N-propylcyclohexan-1-amine has a molecular weight of 294.40 g/mol, XLogP of 3.67, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-6-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-N-propylcyclohexan-1-amine is sourced from PubChem (CID 79853529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).