N-methyl-N-(2-methylcyclohexyl)-5-(2-methylpropyl)pyridin-2-amine

C17H28N2 — CID 178141279

IUPACN-methyl-N-(2-methylcyclohexyl)-5-(2-methylpropyl)pyridin-2-amine
SMILESCC(C)Cc1ccc(N(C)C2CCCCC2C)nc1
InChIInChI=1S/C17H28N2/c1-13(2)11-15-9-10-17(18-12-15)19(4)16-8-6-5-7-14(16)3/h9-10,12-14,16H,5-8,11H2,1-4H3
InChIKeyZKZVIHBQECPQAR-UHFFFAOYSA-N
MW260.43 g/mol
LogP4.30
Rot. Bonds4

About N-methyl-N-(2-methylcyclohexyl)-5-(2-methylpropyl)pyridin-2-amine

N-methyl-N-(2-methylcyclohexyl)-5-(2-methylpropyl)pyridin-2-amine (PubChem CID 178141279) has the molecular formula C17H28N2 and a molecular weight of 260.43 g/mol. Its IUPAC name is N-methyl-N-(2-methylcyclohexyl)-5-(2-methylpropyl)pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-N-(2-methylcyclohexyl)-5-(2-methylpropyl)pyridin-2-amine
PubChem CID178141279
Molecular FormulaC17H28N2
Molecular Weight260.43 g/mol
Exact Mass260.23
IUPAC NameN-methyl-N-(2-methylcyclohexyl)-5-(2-methylpropyl)pyridin-2-amine
SMILESCC(C)Cc1ccc(N(C)C2CCCCC2C)nc1
InChIInChI=1S/C17H28N2/c1-13(2)11-15-9-10-17(18-12-15)19(4)16-8-6-5-7-14(16)3/h9-10,12-14,16H,5-8,11H2,1-4H3
InChIKeyZKZVIHBQECPQAR-UHFFFAOYSA-N
XLogP4.30
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.43
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylcyclohexyl)-5-(2-methylpropyl)pyridin-2-amine?
The IUPAC name of N-methyl-N-(2-methylcyclohexyl)-5-(2-methylpropyl)pyridin-2-amine (CID 178141279) is N-methyl-N-(2-methylcyclohexyl)-5-(2-methylpropyl)pyridin-2-amine.
What is the SMILES notation for N-methyl-N-(2-methylcyclohexyl)-5-(2-methylpropyl)pyridin-2-amine?
The canonical SMILES for N-methyl-N-(2-methylcyclohexyl)-5-(2-methylpropyl)pyridin-2-amine is CC(C)Cc1ccc(N(C)C2CCCCC2C)nc1.
What is the InChIKey of N-methyl-N-(2-methylcyclohexyl)-5-(2-methylpropyl)pyridin-2-amine?
The InChIKey is ZKZVIHBQECPQAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2/c1-13(2)11-15-9-10-17(18-12-15)19(4)16-8-6-5-7-14(16)3/h9-10,12-14,16H,5-8,11H2,1-4H3.
What are the key properties of N-methyl-N-(2-methylcyclohexyl)-5-(2-methylpropyl)pyridin-2-amine?
N-methyl-N-(2-methylcyclohexyl)-5-(2-methylpropyl)pyridin-2-amine has a molecular weight of 260.43 g/mol, XLogP of 4.30, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylcyclohexyl)-5-(2-methylpropyl)pyridin-2-amine is sourced from PubChem (CID 178141279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).