N-(4-ethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine

C14H19F3N2 — CID 63540704

IUPACN-(4-ethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine
SMILESCCC1CCC(Nc2ccc(C(F)(F)F)cn2)CC1
InChIInChI=1S/C14H19F3N2/c1-2-10-3-6-12(7-4-10)19-13-8-5-11(9-18-13)14(15,16)17/h5,8-10,12H,2-4,6-7H2,1H3,(H,18,19)
InChIKeyJTPLQVGVGFQNNJ-UHFFFAOYSA-N
MW272.31 g/mol
LogP4.48
Rot. Bonds3

About N-(4-ethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine

N-(4-ethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine (PubChem CID 63540704) has the molecular formula C14H19F3N2 and a molecular weight of 272.31 g/mol. Its IUPAC name is N-(4-ethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-(4-ethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine
PubChem CID63540704
Molecular FormulaC14H19F3N2
Molecular Weight272.31 g/mol
Exact Mass272.15
IUPAC NameN-(4-ethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine
SMILESCCC1CCC(Nc2ccc(C(F)(F)F)cn2)CC1
InChIInChI=1S/C14H19F3N2/c1-2-10-3-6-12(7-4-10)19-13-8-5-11(9-18-13)14(15,16)17/h5,8-10,12H,2-4,6-7H2,1H3,(H,18,19)
InChIKeyJTPLQVGVGFQNNJ-UHFFFAOYSA-N
XLogP4.48
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,4-dimethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine
CID 64742884
N-piperidin-4-yl-5-(trifluoromethyl)pyridin-2-amine;trihydrochloride
CID 86276661
N-(3-methoxycyclobutyl)-5-(trifluoromethyl)pyridin-2-amine
CID 104576703
4-[[5-(trifluoromethyl)-2-pyridinyl]amino]cyclohexane-1-sulfinic acid
CID 164877980
N-[(3R,5R)-3,5-dimethylcyclohexyl]-5-(trifluoromethyl)pyridin-2-amine
CID 97030726
3-[[5-(trifluoromethyl)-2-pyridinyl]amino]cyclopentane-1-carboxylic acid
CID 66032182
N-(4-ethylcyclohexyl)-2-[[5-(trifluoromethyl)-2-pyridinyl]sulfanyl]acetamide
CID 112817234
4-N-(5-tert-butyl-2-pyridinyl)cyclohexane-1,4-diamine
CID 114011527
methyl 4-[[5-(trifluoromethyl)-2-pyridinyl]amino]piperidine-1-carboxylate
CID 133273523
N-(3-cyclopropylpropyl)-5-(trifluoromethyl)pyridin-2-amine
CID 115637573
N-cyclopropyl-5-(2-methoxypropan-2-yl)pyridin-2-amine
CID 59869056
4-N-(4-ethylcyclohexyl)-2-(trifluoromethyl)pyrimidine-4,6-diamine
CID 106771197

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-(4-ethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine (CID 63540704) is N-(4-ethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-(4-ethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-(4-ethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine is CCC1CCC(Nc2ccc(C(F)(F)F)cn2)CC1.
What is the InChIKey of N-(4-ethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine?
The InChIKey is JTPLQVGVGFQNNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F3N2/c1-2-10-3-6-12(7-4-10)19-13-8-5-11(9-18-13)14(15,16)17/h5,8-10,12H,2-4,6-7H2,1H3,(H,18,19).
What are the key properties of N-(4-ethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine?
N-(4-ethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine has a molecular weight of 272.31 g/mol, XLogP of 4.48, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 63540704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).