(4-methylcyclohexyl)-[4-(trifluoromethyl)cyclohexyl]methanamine

C15H26F3N — CID 105153876

IUPAC(4-methylcyclohexyl)-[4-(trifluoromethyl)cyclohexyl]methanamine
SMILESCC1CCC(C(N)C2CCC(C(F)(F)F)CC2)CC1
InChIInChI=1S/C15H26F3N/c1-10-2-4-11(5-3-10)14(19)12-6-8-13(9-7-12)15(16,17)18/h10-14H,2-9,19H2,1H3
InChIKeyOVDLFSOXZKSPAJ-UHFFFAOYSA-N
MW277.37 g/mol
LogP4.51
Rot. Bonds2

About (4-methylcyclohexyl)-[4-(trifluoromethyl)cyclohexyl]methanamine

(4-methylcyclohexyl)-[4-(trifluoromethyl)cyclohexyl]methanamine (PubChem CID 105153876) has the molecular formula C15H26F3N and a molecular weight of 277.37 g/mol. Its IUPAC name is (4-methylcyclohexyl)-[4-(trifluoromethyl)cyclohexyl]methanamine.

Molecular Properties

Compound Name(4-methylcyclohexyl)-[4-(trifluoromethyl)cyclohexyl]methanamine
PubChem CID105153876
Molecular FormulaC15H26F3N
Molecular Weight277.37 g/mol
Exact Mass277.20
IUPAC Name(4-methylcyclohexyl)-[4-(trifluoromethyl)cyclohexyl]methanamine
SMILESCC1CCC(C(N)C2CCC(C(F)(F)F)CC2)CC1
InChIInChI=1S/C15H26F3N/c1-10-2-4-11(5-3-10)14(19)12-6-8-13(9-7-12)15(16,17)18/h10-14H,2-9,19H2,1H3
InChIKeyOVDLFSOXZKSPAJ-UHFFFAOYSA-N
XLogP4.51
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

cyclobutyl-[4-(trifluoromethyl)cyclohexyl]methanamine
CID 105187570
1,4-dimethylcyclohexane;1-methyl-4-(trifluoromethyl)cyclohexane
CID 90867997
1-methyl-4-(trifluoromethyl)cyclohexane;propane
CID 162029179
3-aminoprop-1-en-2-ol;1-methyl-4-(trifluoromethyl)cyclohexane
CID 164530936
1-methyl-4-[[4-(trifluoromethyl)cyclohexyl]methyl]cyclohexane
CID 59015376
2-aminoacetic acid;1-methyl-4-(trifluoromethyl)cyclohexane
CID 164530893
(4-tert-butylcyclohexyl)-(3,5-dimethylcyclohexyl)methanamine
CID 65402362
(2S)-2-amino-2-[4-(trifluoromethyl)cyclohexyl]acetonitrile
CID 166454783
(1S)-3,3,3-trifluoro-1-(4-methylcyclohexyl)propan-1-amine
CID 104941345
(4-methylcyclohexyl)-(thiolan-3-yl)methanamine
CID 105153829
[2-methyl-1-[4-(trifluoromethyl)cyclohexyl]propyl]hydrazine
CID 105281756
1-(2-methylpropyl)-4-(trifluoromethyl)cyclohexane
CID 71231425

Frequently Asked Questions

What is the IUPAC name of (4-methylcyclohexyl)-[4-(trifluoromethyl)cyclohexyl]methanamine?
The IUPAC name of (4-methylcyclohexyl)-[4-(trifluoromethyl)cyclohexyl]methanamine (CID 105153876) is (4-methylcyclohexyl)-[4-(trifluoromethyl)cyclohexyl]methanamine.
What is the SMILES notation for (4-methylcyclohexyl)-[4-(trifluoromethyl)cyclohexyl]methanamine?
The canonical SMILES for (4-methylcyclohexyl)-[4-(trifluoromethyl)cyclohexyl]methanamine is CC1CCC(C(N)C2CCC(C(F)(F)F)CC2)CC1.
What is the InChIKey of (4-methylcyclohexyl)-[4-(trifluoromethyl)cyclohexyl]methanamine?
The InChIKey is OVDLFSOXZKSPAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26F3N/c1-10-2-4-11(5-3-10)14(19)12-6-8-13(9-7-12)15(16,17)18/h10-14H,2-9,19H2,1H3.
What are the key properties of (4-methylcyclohexyl)-[4-(trifluoromethyl)cyclohexyl]methanamine?
(4-methylcyclohexyl)-[4-(trifluoromethyl)cyclohexyl]methanamine has a molecular weight of 277.37 g/mol, XLogP of 4.51, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylcyclohexyl)-[4-(trifluoromethyl)cyclohexyl]methanamine is sourced from PubChem (CID 105153876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).