2-(1-adamantylmethyl)pyridine

C16H21N — CID 584969

IUPAC2-(1-adamantylmethyl)pyridine
SMILESc1ccc(CC23CC4CC(CC(C4)C2)C3)nc1
InChIInChI=1S/C16H21N/c1-2-4-17-15(3-1)11-16-8-12-5-13(9-16)7-14(6-12)10-16/h1-4,12-14H,5-11H2
InChIKeyGGNYZRAUXYTWQL-UHFFFAOYSA-N
MW227.35 g/mol
LogP3.84
Rot. Bonds2

About 2-(1-adamantylmethyl)pyridine

2-(1-adamantylmethyl)pyridine (PubChem CID 584969) has the molecular formula C16H21N and a molecular weight of 227.35 g/mol. Its IUPAC name is 2-(1-adamantylmethyl)pyridine.

Molecular Properties

Compound Name2-(1-adamantylmethyl)pyridine
PubChem CID584969
Molecular FormulaC16H21N
Molecular Weight227.35 g/mol
Exact Mass227.17
IUPAC Name2-(1-adamantylmethyl)pyridine
SMILESc1ccc(CC23CC4CC(CC(C4)C2)C3)nc1
InChIInChI=1S/C16H21N/c1-2-4-17-15(3-1)11-16-8-12-5-13(9-16)7-14(6-12)10-16/h1-4,12-14H,5-11H2
InChIKeyGGNYZRAUXYTWQL-UHFFFAOYSA-N
XLogP3.84
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-(1-adamantylmethyl)pyridine with MolForge

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

Launch Full Analysis

Related Compounds

1-(1-adamantyl)-3-pyridin-2-ylpropan-2-ol
CID 79995222
1-(pyridin-2-ylmethyl)cyclopropan-1-amine
CID 59327087
3-(pyridin-2-ylmethyl)-8-thiabicyclo[3.2.1]octan-3-ol
CID 171959354
2-(1-adamantyl)-N-[4-(2-pyridin-2-ylethyl)phenyl]acetamide
CID 46786313
2-(1-adamantyl)-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)acetamide
CID 108755936
1-(1-adamantyl)-N-(pyridin-2-ylmethyl)ethanamine;dihydrochloride
CID 163327971
1-(1-adamantylamino)-3-pyridin-2-ylpropan-2-one
CID 158709731
2-[(3-fluoroazetidin-3-yl)methyl]pyridine
CID 112563329
3-(1-adamantyl)-1,1-bis(pyridin-2-ylmethyl)thiourea
CID 23736254
N-(3-pyridin-2-ylpropyl)adamantane-1-carboxamide
CID 110661008
3-(1-adamantyl)-1-methyl-1-(pyridin-2-ylmethyl)thiourea
CID 13414451
1-(pyridin-2-ylmethyl)cyclobutan-1-ol
CID 79081302

Frequently Asked Questions

What is the IUPAC name of 2-(1-adamantylmethyl)pyridine?
The IUPAC name of 2-(1-adamantylmethyl)pyridine (CID 584969) is 2-(1-adamantylmethyl)pyridine.
What is the SMILES notation for 2-(1-adamantylmethyl)pyridine?
The canonical SMILES for 2-(1-adamantylmethyl)pyridine is c1ccc(CC23CC4CC(CC(C4)C2)C3)nc1.
What is the InChIKey of 2-(1-adamantylmethyl)pyridine?
The InChIKey is GGNYZRAUXYTWQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N/c1-2-4-17-15(3-1)11-16-8-12-5-13(9-16)7-14(6-12)10-16/h1-4,12-14H,5-11H2.
What are the key properties of 2-(1-adamantylmethyl)pyridine?
2-(1-adamantylmethyl)pyridine has a molecular weight of 227.35 g/mol, XLogP of 3.84, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-adamantylmethyl)pyridine is sourced from PubChem (CID 584969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).