ethane;N-methyl-N-(2-methylcyclohexyl)-5-propylpyridin-2-amine

C18H32N2 — CID 178141713

IUPACethane;N-methyl-N-(2-methylcyclohexyl)-5-propylpyridin-2-amine
SMILESCC.CCCc1ccc(N(C)C2CCCCC2C)nc1
InChIInChI=1S/C16H26N2.C2H6/c1-4-7-14-10-11-16(17-12-14)18(3)15-9-6-5-8-13(15)2;1-2/h10-13,15H,4-9H2,1-3H3;1-2H3
InChIKeyGWGHDPPRBLJYOY-UHFFFAOYSA-N
MW276.47 g/mol
LogP5.08
Rot. Bonds4

About ethane;N-methyl-N-(2-methylcyclohexyl)-5-propylpyridin-2-amine

ethane;N-methyl-N-(2-methylcyclohexyl)-5-propylpyridin-2-amine (PubChem CID 178141713) has the molecular formula C18H32N2 and a molecular weight of 276.47 g/mol. Its IUPAC name is ethane;N-methyl-N-(2-methylcyclohexyl)-5-propylpyridin-2-amine.

Molecular Properties

Compound Nameethane;N-methyl-N-(2-methylcyclohexyl)-5-propylpyridin-2-amine
PubChem CID178141713
Molecular FormulaC18H32N2
Molecular Weight276.47 g/mol
Exact Mass276.26
IUPAC Nameethane;N-methyl-N-(2-methylcyclohexyl)-5-propylpyridin-2-amine
SMILESCC.CCCc1ccc(N(C)C2CCCCC2C)nc1
InChIInChI=1S/C16H26N2.C2H6/c1-4-7-14-10-11-16(17-12-14)18(3)15-9-6-5-8-13(15)2;1-2/h10-13,15H,4-9H2,1-3H3;1-2H3
InChIKeyGWGHDPPRBLJYOY-UHFFFAOYSA-N
XLogP5.08
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.47
LogP ≤ 55.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze ethane;N-methyl-N-(2-methylcyclohexyl)-5-propylpyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethane;N-methyl-N-(2-methylcyclohexyl)-5-propylpyridin-2-amine?
The IUPAC name of ethane;N-methyl-N-(2-methylcyclohexyl)-5-propylpyridin-2-amine (CID 178141713) is ethane;N-methyl-N-(2-methylcyclohexyl)-5-propylpyridin-2-amine.
What is the SMILES notation for ethane;N-methyl-N-(2-methylcyclohexyl)-5-propylpyridin-2-amine?
The canonical SMILES for ethane;N-methyl-N-(2-methylcyclohexyl)-5-propylpyridin-2-amine is CC.CCCc1ccc(N(C)C2CCCCC2C)nc1.
What is the InChIKey of ethane;N-methyl-N-(2-methylcyclohexyl)-5-propylpyridin-2-amine?
The InChIKey is GWGHDPPRBLJYOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2.C2H6/c1-4-7-14-10-11-16(17-12-14)18(3)15-9-6-5-8-13(15)2;1-2/h10-13,15H,4-9H2,1-3H3;1-2H3.
What are the key properties of ethane;N-methyl-N-(2-methylcyclohexyl)-5-propylpyridin-2-amine?
ethane;N-methyl-N-(2-methylcyclohexyl)-5-propylpyridin-2-amine has a molecular weight of 276.47 g/mol, XLogP of 5.08, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-methyl-N-(2-methylcyclohexyl)-5-propylpyridin-2-amine is sourced from PubChem (CID 178141713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).