N-(3,4-dimethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine

C14H19F3N2 — CID 64742884

IUPACN-(3,4-dimethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine
SMILESCC1CCC(Nc2ccc(C(F)(F)F)cn2)CC1C
InChIInChI=1S/C14H19F3N2/c1-9-3-5-12(7-10(9)2)19-13-6-4-11(8-18-13)14(15,16)17/h4,6,8-10,12H,3,5,7H2,1-2H3,(H,18,19)
InChIKeyUAIUXSUUIYUFOC-UHFFFAOYSA-N
MW272.31 g/mol
LogP4.34
Rot. Bonds2

About N-(3,4-dimethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine

N-(3,4-dimethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine (PubChem CID 64742884) has the molecular formula C14H19F3N2 and a molecular weight of 272.31 g/mol. Its IUPAC name is N-(3,4-dimethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-(3,4-dimethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine
PubChem CID64742884
Molecular FormulaC14H19F3N2
Molecular Weight272.31 g/mol
Exact Mass272.15
IUPAC NameN-(3,4-dimethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine
SMILESCC1CCC(Nc2ccc(C(F)(F)F)cn2)CC1C
InChIInChI=1S/C14H19F3N2/c1-9-3-5-12(7-10(9)2)19-13-6-4-11(8-18-13)14(15,16)17/h4,6,8-10,12H,3,5,7H2,1-2H3,(H,18,19)
InChIKeyUAIUXSUUIYUFOC-UHFFFAOYSA-N
XLogP4.34
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[[5-(trifluoromethyl)-2-pyridinyl]amino]cyclopentane-1-carboxylic acid
CID 66032182
N-[(3R,5R)-3,5-dimethylcyclohexyl]-5-(trifluoromethyl)pyridin-2-amine
CID 97030726
N-(4-ethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine
CID 63540704
N-(3-methoxycyclobutyl)-5-(trifluoromethyl)pyridin-2-amine
CID 104576703
N-piperidin-4-yl-5-(trifluoromethyl)pyridin-2-amine;trihydrochloride
CID 86276661
4-[[5-(trifluoromethyl)-2-pyridinyl]amino]cyclohexane-1-sulfinic acid
CID 164877980
methyl 4-[[5-(trifluoromethyl)-2-pyridinyl]amino]piperidine-1-carboxylate
CID 133273523
ethyl 6-[(3,4-dimethylcyclohexyl)amino]pyridine-3-carboxylate
CID 64742881
N-cyclopropyl-5-(2-methoxypropan-2-yl)pyridin-2-amine
CID 59869056
N-(2,2-dimethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine
CID 79870374
4-N-(5-tert-butyl-2-pyridinyl)cyclohexane-1,4-diamine
CID 114011527
tert-butyl 4-[[5-(trifluoromethyl)-2-pyridinyl]amino]piperidine-1-carboxylate;N-piperidin-1-ium-4-yl-5-(trifluoromethyl)pyridin-2-amine;chloride
CID 158175517

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-(3,4-dimethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine (CID 64742884) is N-(3,4-dimethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-(3,4-dimethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-(3,4-dimethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine is CC1CCC(Nc2ccc(C(F)(F)F)cn2)CC1C.
What is the InChIKey of N-(3,4-dimethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine?
The InChIKey is UAIUXSUUIYUFOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F3N2/c1-9-3-5-12(7-10(9)2)19-13-6-4-11(8-18-13)14(15,16)17/h4,6,8-10,12H,3,5,7H2,1-2H3,(H,18,19).
What are the key properties of N-(3,4-dimethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine?
N-(3,4-dimethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine has a molecular weight of 272.31 g/mol, XLogP of 4.34, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 64742884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).