N-(2,4-dimethylcyclohexyl)-5-methylpyridin-2-amine

C14H22N2 — CID 63994524

IUPACN-(2,4-dimethylcyclohexyl)-5-methylpyridin-2-amine
SMILESCc1ccc(NC2CCC(C)CC2C)nc1
InChIInChI=1S/C14H22N2/c1-10-4-6-13(12(3)8-10)16-14-7-5-11(2)9-15-14/h5,7,9-10,12-13H,4,6,8H2,1-3H3,(H,15,16)
InChIKeyLUYJINXBWACYJH-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.63
Rot. Bonds2

About N-(2,4-dimethylcyclohexyl)-5-methylpyridin-2-amine

N-(2,4-dimethylcyclohexyl)-5-methylpyridin-2-amine (PubChem CID 63994524) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is N-(2,4-dimethylcyclohexyl)-5-methylpyridin-2-amine.

Molecular Properties

Compound NameN-(2,4-dimethylcyclohexyl)-5-methylpyridin-2-amine
PubChem CID63994524
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC NameN-(2,4-dimethylcyclohexyl)-5-methylpyridin-2-amine
SMILESCc1ccc(NC2CCC(C)CC2C)nc1
InChIInChI=1S/C14H22N2/c1-10-4-6-13(12(3)8-10)16-14-7-5-11(2)9-15-14/h5,7,9-10,12-13H,4,6,8H2,1-3H3,(H,15,16)
InChIKeyLUYJINXBWACYJH-UHFFFAOYSA-N
XLogP3.63
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylcyclohexyl)-5-methylpyridin-2-amine?
The IUPAC name of N-(2,4-dimethylcyclohexyl)-5-methylpyridin-2-amine (CID 63994524) is N-(2,4-dimethylcyclohexyl)-5-methylpyridin-2-amine.
What is the SMILES notation for N-(2,4-dimethylcyclohexyl)-5-methylpyridin-2-amine?
The canonical SMILES for N-(2,4-dimethylcyclohexyl)-5-methylpyridin-2-amine is Cc1ccc(NC2CCC(C)CC2C)nc1.
What is the InChIKey of N-(2,4-dimethylcyclohexyl)-5-methylpyridin-2-amine?
The InChIKey is LUYJINXBWACYJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-10-4-6-13(12(3)8-10)16-14-7-5-11(2)9-15-14/h5,7,9-10,12-13H,4,6,8H2,1-3H3,(H,15,16).
What are the key properties of N-(2,4-dimethylcyclohexyl)-5-methylpyridin-2-amine?
N-(2,4-dimethylcyclohexyl)-5-methylpyridin-2-amine has a molecular weight of 218.34 g/mol, XLogP of 3.63, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylcyclohexyl)-5-methylpyridin-2-amine is sourced from PubChem (CID 63994524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).