(4-cyclohexylsulfanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazine

C13H22N6S — CID 80923900

IUPAC(4-cyclohexylsulfanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazine
SMILESNNc1nc(SC2CCCCC2)nc(N2CCCC2)n1
InChIInChI=1S/C13H22N6S/c14-18-11-15-12(19-8-4-5-9-19)17-13(16-11)20-10-6-2-1-3-7-10/h10H,1-9,14H2,(H,15,16,17,18)
InChIKeyVVTQHOKCAPWSKL-UHFFFAOYSA-N
MW294.43 g/mol
LogP2.18
Rot. Bonds4

About (4-cyclohexylsulfanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazine

(4-cyclohexylsulfanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazine (PubChem CID 80923900) has the molecular formula C13H22N6S and a molecular weight of 294.43 g/mol. Its IUPAC name is (4-cyclohexylsulfanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazine.

Molecular Properties

Compound Name(4-cyclohexylsulfanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazine
PubChem CID80923900
Molecular FormulaC13H22N6S
Molecular Weight294.43 g/mol
Exact Mass294.16
IUPAC Name(4-cyclohexylsulfanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazine
SMILESNNc1nc(SC2CCCCC2)nc(N2CCCC2)n1
InChIInChI=1S/C13H22N6S/c14-18-11-15-12(19-8-4-5-9-19)17-13(16-11)20-10-6-2-1-3-7-10/h10H,1-9,14H2,(H,15,16,17,18)
InChIKeyVVTQHOKCAPWSKL-UHFFFAOYSA-N
XLogP2.18
TPSA79.96 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.43
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (4-cyclohexylsulfanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazine 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

4-cyclohexylsulfanyl-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 80886210
(4-ethylsulfanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazine
CID 80925076
1-(4-hydrazinyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)piperidin-4-ol
CID 80912793
4-cyclohexylsulfanyl-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine
CID 80923120
(4-cyclohexyloxy-6-piperidin-1-yl-1,3,5-triazin-2-yl)hydrazine
CID 80905831
(4-pyrimidin-2-ylsulfanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazine
CID 80924900
(4-butan-2-ylsulfanyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)hydrazine
CID 80924912
[4-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazine
CID 80925112
(4-piperidin-1-yl-6-thiophen-2-ylsulfanyl-1,3,5-triazin-2-yl)hydrazine
CID 80925437
(4-piperidin-1-yl-6-pyrimidin-4-ylsulfanyl-1,3,5-triazin-2-yl)hydrazine
CID 80928949
[4-(5-methylpyrimidin-2-yl)sulfanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl]hydrazine
CID 80924947
[4-(4,4-dimethylpiperidin-1-yl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl]hydrazine
CID 80905338

Frequently Asked Questions

What is the IUPAC name of (4-cyclohexylsulfanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazine?
The IUPAC name of (4-cyclohexylsulfanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazine (CID 80923900) is (4-cyclohexylsulfanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazine.
What is the SMILES notation for (4-cyclohexylsulfanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazine?
The canonical SMILES for (4-cyclohexylsulfanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazine is NNc1nc(SC2CCCCC2)nc(N2CCCC2)n1.
What is the InChIKey of (4-cyclohexylsulfanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazine?
The InChIKey is VVTQHOKCAPWSKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N6S/c14-18-11-15-12(19-8-4-5-9-19)17-13(16-11)20-10-6-2-1-3-7-10/h10H,1-9,14H2,(H,15,16,17,18).
What are the key properties of (4-cyclohexylsulfanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazine?
(4-cyclohexylsulfanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazine has a molecular weight of 294.43 g/mol, XLogP of 2.18, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclohexylsulfanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)hydrazine is sourced from PubChem (CID 80923900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).