4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine

C12H17N7S — CID 80932610

IUPAC4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine
SMILESCN(C)c1nc(NN)nc(N2CCc3sccc3C2)n1
InChIInChI=1S/C12H17N7S/c1-18(2)11-14-10(17-13)15-12(16-11)19-5-3-9-8(7-19)4-6-20-9/h4,6H,3,5,7,13H2,1-2H3,(H,14,15,16,17)
InChIKeyJHKOOWRSFJWSNU-UHFFFAOYSA-N
MW291.38 g/mol
LogP0.85
Rot. Bonds3

About 4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine

4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine (PubChem CID 80932610) has the molecular formula C12H17N7S and a molecular weight of 291.38 g/mol. Its IUPAC name is 4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine
PubChem CID80932610
Molecular FormulaC12H17N7S
Molecular Weight291.38 g/mol
Exact Mass291.13
IUPAC Name4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine
SMILESCN(C)c1nc(NN)nc(N2CCc3sccc3C2)n1
InChIInChI=1S/C12H17N7S/c1-18(2)11-14-10(17-13)15-12(16-11)19-5-3-9-8(7-19)4-6-20-9/h4,6H,3,5,7,13H2,1-2H3,(H,14,15,16,17)
InChIKeyJHKOOWRSFJWSNU-UHFFFAOYSA-N
XLogP0.85
TPSA83.20 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

6-(3,4-dihydro-1H-isoquinolin-2-yl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
CID 80751354
3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1H-1,2,4-triazol-5-amine
CID 66276232
5-(4-chloro-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 62868181
4-hydrazinyl-N,N-dimethyl-6-(1-oxo-1,4-thiazinan-4-yl)-1,3,5-triazin-2-amine
CID 80905207
[2-tert-butyl-6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyrimidin-4-yl]hydrazine
CID 80968402
4-(3,4-dimethoxypyrrolidin-1-yl)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine
CID 103542142
4-(2-azaspiro[4.4]nonan-2-yl)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine
CID 114279647
[6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-4-(trifluoromethyl)-2-pyridinyl]hydrazine
CID 102720959
1-[4-(dimethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]piperidin-3-ol
CID 80906673
4-hydrazinyl-N,N-dimethyl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)-1,3,5-triazin-2-amine
CID 80905094
4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-5-fluoro-N-methylpyrimidin-2-amine
CID 80764971
1-[4-[4-(dimethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]-1,4-diazepan-1-yl]ethanone
CID 80901624

Frequently Asked Questions

What is the IUPAC name of 4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine (CID 80932610) is 4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine is CN(C)c1nc(NN)nc(N2CCc3sccc3C2)n1.
What is the InChIKey of 4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine?
The InChIKey is JHKOOWRSFJWSNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N7S/c1-18(2)11-14-10(17-13)15-12(16-11)19-5-3-9-8(7-19)4-6-20-9/h4,6H,3,5,7,13H2,1-2H3,(H,14,15,16,17).
What are the key properties of 4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine?
4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine has a molecular weight of 291.38 g/mol, XLogP of 0.85, 3 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 80932610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).