N-cyclohexyl-5-pyrrolidin-1-yl-1,2,4-triazin-3-amine

C13H21N5 — CID 112941042

IUPACN-cyclohexyl-5-pyrrolidin-1-yl-1,2,4-triazin-3-amine
SMILESc1nnc(NC2CCCCC2)nc1N1CCCC1
InChIInChI=1S/C13H21N5/c1-2-6-11(7-3-1)15-13-16-12(10-14-17-13)18-8-4-5-9-18/h10-11H,1-9H2,(H,15,16,17)
InChIKeyUZMMZIQWCLIEHN-UHFFFAOYSA-N
MW247.35 g/mol
LogP2.22
Rot. Bonds3

About N-cyclohexyl-5-pyrrolidin-1-yl-1,2,4-triazin-3-amine

N-cyclohexyl-5-pyrrolidin-1-yl-1,2,4-triazin-3-amine (PubChem CID 112941042) has the molecular formula C13H21N5 and a molecular weight of 247.35 g/mol. Its IUPAC name is N-cyclohexyl-5-pyrrolidin-1-yl-1,2,4-triazin-3-amine.

Molecular Properties

Compound NameN-cyclohexyl-5-pyrrolidin-1-yl-1,2,4-triazin-3-amine
PubChem CID112941042
Molecular FormulaC13H21N5
Molecular Weight247.35 g/mol
Exact Mass247.18
IUPAC NameN-cyclohexyl-5-pyrrolidin-1-yl-1,2,4-triazin-3-amine
SMILESc1nnc(NC2CCCCC2)nc1N1CCCC1
InChIInChI=1S/C13H21N5/c1-2-6-11(7-3-1)15-13-16-12(10-14-17-13)18-8-4-5-9-18/h10-11H,1-9H2,(H,15,16,17)
InChIKeyUZMMZIQWCLIEHN-UHFFFAOYSA-N
XLogP2.22
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.35
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-cyclohexyl-5-pyrrolidin-1-yl-1,2,4-triazin-3-amine 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-cyclopropyl-5-piperidin-1-yl-1,2,4-triazin-3-amine
CID 112939289
N-cyclohexyl-5-(4-ethylpiperazin-1-yl)-1,2,4-triazin-3-amine
CID 112942382
1-[4-[3-(cyclohexylamino)-1,2,4-triazin-5-yl]piperazin-1-yl]ethanone
CID 112942384
N-cyclopentyl-5-[4-(4-fluorophenyl)piperazin-1-yl]-1,2,4-triazin-3-amine
CID 112941659
N-cyclopentyl-5-(2-ethylpiperidin-1-yl)-1,2,4-triazin-3-amine
CID 112941690
N-cyclohexyl-5-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1,2,4-triazin-3-amine
CID 112942438
5-(azepan-1-yl)-N-propan-2-yl-1,2,4-triazin-3-amine
CID 112938975
N-cycloheptyl-5-(2,3-dihydroindol-1-yl)-1,2,4-triazin-3-amine
CID 112959267
4-chloro-N-cyclopentyl-6-pyrrolidin-1-ylpyrimidin-2-amine
CID 19428512
N-cyclopentyl-5-(3,4-dihydro-2H-quinolin-1-yl)-1,2,4-triazin-3-amine
CID 112941703
N-phenyl-5-piperidin-1-yl-1,2,4-triazin-3-amine
CID 112941887
N-(2-methylpropyl)-5-piperidin-1-yl-1,2,4-triazin-3-amine
CID 112940461

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-5-pyrrolidin-1-yl-1,2,4-triazin-3-amine?
The IUPAC name of N-cyclohexyl-5-pyrrolidin-1-yl-1,2,4-triazin-3-amine (CID 112941042) is N-cyclohexyl-5-pyrrolidin-1-yl-1,2,4-triazin-3-amine.
What is the SMILES notation for N-cyclohexyl-5-pyrrolidin-1-yl-1,2,4-triazin-3-amine?
The canonical SMILES for N-cyclohexyl-5-pyrrolidin-1-yl-1,2,4-triazin-3-amine is c1nnc(NC2CCCCC2)nc1N1CCCC1.
What is the InChIKey of N-cyclohexyl-5-pyrrolidin-1-yl-1,2,4-triazin-3-amine?
The InChIKey is UZMMZIQWCLIEHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5/c1-2-6-11(7-3-1)15-13-16-12(10-14-17-13)18-8-4-5-9-18/h10-11H,1-9H2,(H,15,16,17).
What are the key properties of N-cyclohexyl-5-pyrrolidin-1-yl-1,2,4-triazin-3-amine?
N-cyclohexyl-5-pyrrolidin-1-yl-1,2,4-triazin-3-amine has a molecular weight of 247.35 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-5-pyrrolidin-1-yl-1,2,4-triazin-3-amine is sourced from PubChem (CID 112941042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).