N-(1-adamantyl)-6-methylpyridin-2-amine

C16H22N2 — CID 10131023

IUPACN-(1-adamantyl)-6-methylpyridin-2-amine
SMILESCc1cccc(NC23CC4CC(CC(C4)C2)C3)n1
InChIInChI=1S/C16H22N2/c1-11-3-2-4-15(17-11)18-16-8-12-5-13(9-16)7-14(6-12)10-16/h2-4,12-14H,5-10H2,1H3,(H,17,18)
InChIKeyJSQBMOALUDINKI-UHFFFAOYSA-N
MW242.37 g/mol
LogP3.77
Rot. Bonds2

About N-(1-adamantyl)-6-methylpyridin-2-amine

N-(1-adamantyl)-6-methylpyridin-2-amine (PubChem CID 10131023) has the molecular formula C16H22N2 and a molecular weight of 242.37 g/mol. Its IUPAC name is N-(1-adamantyl)-6-methylpyridin-2-amine.

Molecular Properties

Compound NameN-(1-adamantyl)-6-methylpyridin-2-amine
PubChem CID10131023
Molecular FormulaC16H22N2
Molecular Weight242.37 g/mol
Exact Mass242.18
IUPAC NameN-(1-adamantyl)-6-methylpyridin-2-amine
SMILESCc1cccc(NC23CC4CC(CC(C4)C2)C3)n1
InChIInChI=1S/C16H22N2/c1-11-3-2-4-15(17-11)18-16-8-12-5-13(9-16)7-14(6-12)10-16/h2-4,12-14H,5-10H2,1H3,(H,17,18)
InChIKeyJSQBMOALUDINKI-UHFFFAOYSA-N
XLogP3.77
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.37
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-adamantyl)-6-methylpyridin-2-amine?
The IUPAC name of N-(1-adamantyl)-6-methylpyridin-2-amine (CID 10131023) is N-(1-adamantyl)-6-methylpyridin-2-amine.
What is the SMILES notation for N-(1-adamantyl)-6-methylpyridin-2-amine?
The canonical SMILES for N-(1-adamantyl)-6-methylpyridin-2-amine is Cc1cccc(NC23CC4CC(CC(C4)C2)C3)n1.
What is the InChIKey of N-(1-adamantyl)-6-methylpyridin-2-amine?
The InChIKey is JSQBMOALUDINKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2/c1-11-3-2-4-15(17-11)18-16-8-12-5-13(9-16)7-14(6-12)10-16/h2-4,12-14H,5-10H2,1H3,(H,17,18).
What are the key properties of N-(1-adamantyl)-6-methylpyridin-2-amine?
N-(1-adamantyl)-6-methylpyridin-2-amine has a molecular weight of 242.37 g/mol, XLogP of 3.77, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-adamantyl)-6-methylpyridin-2-amine is sourced from PubChem (CID 10131023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).