N-(pyrazin-2-ylmethyl)cyclooctanamine

C13H21N3 — CID 62761254

IUPACN-(pyrazin-2-ylmethyl)cyclooctanamine
SMILESc1cnc(CNC2CCCCCCC2)cn1
InChIInChI=1S/C13H21N3/c1-2-4-6-12(7-5-3-1)16-11-13-10-14-8-9-15-13/h8-10,12,16H,1-7,11H2
InChIKeyJWEPRUAAVYIDIV-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.68
Rot. Bonds3

About N-(pyrazin-2-ylmethyl)cyclooctanamine

N-(pyrazin-2-ylmethyl)cyclooctanamine (PubChem CID 62761254) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is N-(pyrazin-2-ylmethyl)cyclooctanamine.

Molecular Properties

Compound NameN-(pyrazin-2-ylmethyl)cyclooctanamine
PubChem CID62761254
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC NameN-(pyrazin-2-ylmethyl)cyclooctanamine
SMILESc1cnc(CNC2CCCCCCC2)cn1
InChIInChI=1S/C13H21N3/c1-2-4-6-12(7-5-3-1)16-11-13-10-14-8-9-15-13/h8-10,12,16H,1-7,11H2
InChIKeyJWEPRUAAVYIDIV-UHFFFAOYSA-N
XLogP2.68
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(pyrazin-2-ylmethyl)cyclooctanamine 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

N-(pyrazin-2-ylmethyl)cyclopentanamine
CID 60985603
(3R)-N-(pyrazin-2-ylmethyl)piperidin-3-amine
CID 71636732
cis-(1R,2S)-2-N-(pyrazin-2-ylmethyl)cyclohexane-1,2-diamine
CID 97168885
(3R)-N-(pyrazin-2-ylmethyl)pyrrolidin-3-amine
CID 71304599
N-(pyrazin-2-ylmethyl)-1-pyrimidin-2-ylpiperidin-4-amine
CID 62761801
(3S)-N-(pyrazin-2-ylmethyl)pyrrolidin-3-amine;hydrochloride
CID 71636752
trans-(1R,2R)-2-(pyrazin-2-ylmethylamino)cyclopentan-1-ol
CID 126846554
N-(pyrazin-2-ylmethyl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine
CID 55110319
2-cyclopentyloxy-N-(pyrazin-2-ylmethyl)ethanamine
CID 63825157
4-cyclopentyloxy-N-(pyrazin-2-ylmethyl)aniline
CID 62762348
N-(pyridin-4-ylmethyl)cyclooctanamine
CID 4722994
N'-cyclopentyl-N'-methyl-N-(pyrazin-2-ylmethyl)ethane-1,2-diamine
CID 55204874

Frequently Asked Questions

What is the IUPAC name of N-(pyrazin-2-ylmethyl)cyclooctanamine?
The IUPAC name of N-(pyrazin-2-ylmethyl)cyclooctanamine (CID 62761254) is N-(pyrazin-2-ylmethyl)cyclooctanamine.
What is the SMILES notation for N-(pyrazin-2-ylmethyl)cyclooctanamine?
The canonical SMILES for N-(pyrazin-2-ylmethyl)cyclooctanamine is c1cnc(CNC2CCCCCCC2)cn1.
What is the InChIKey of N-(pyrazin-2-ylmethyl)cyclooctanamine?
The InChIKey is JWEPRUAAVYIDIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-2-4-6-12(7-5-3-1)16-11-13-10-14-8-9-15-13/h8-10,12,16H,1-7,11H2.
What are the key properties of N-(pyrazin-2-ylmethyl)cyclooctanamine?
N-(pyrazin-2-ylmethyl)cyclooctanamine has a molecular weight of 219.33 g/mol, XLogP of 2.68, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyrazin-2-ylmethyl)cyclooctanamine is sourced from PubChem (CID 62761254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).