3,5-dichloro-6-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)pyridin-2-amine

C11H18Cl2N4S — CID 102762521

IUPAC3,5-dichloro-6-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)pyridin-2-amine
SMILESCCC(CSC)N(C)c1nc(NN)c(Cl)cc1Cl
InChIInChI=1S/C11H18Cl2N4S/c1-4-7(6-18-3)17(2)11-9(13)5-8(12)10(15-11)16-14/h5,7H,4,6,14H2,1-3H3,(H,15,16)
InChIKeyQPKDWIVWJQIQCG-UHFFFAOYSA-N
MW309.27 g/mol
LogP3.25
Rot. Bonds6

About 3,5-dichloro-6-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)pyridin-2-amine

3,5-dichloro-6-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)pyridin-2-amine (PubChem CID 102762521) has the molecular formula C11H18Cl2N4S and a molecular weight of 309.27 g/mol. Its IUPAC name is 3,5-dichloro-6-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)pyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-6-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)pyridin-2-amine
PubChem CID102762521
Molecular FormulaC11H18Cl2N4S
Molecular Weight309.27 g/mol
Exact Mass308.06
IUPAC Name3,5-dichloro-6-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)pyridin-2-amine
SMILESCCC(CSC)N(C)c1nc(NN)c(Cl)cc1Cl
InChIInChI=1S/C11H18Cl2N4S/c1-4-7(6-18-3)17(2)11-9(13)5-8(12)10(15-11)16-14/h5,7H,4,6,14H2,1-3H3,(H,15,16)
InChIKeyQPKDWIVWJQIQCG-UHFFFAOYSA-N
XLogP3.25
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.27
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

3,5-dichloro-6-hydrazinyl-N-(1-methoxypropan-2-yl)-N-methylpyridin-2-amine
CID 102761760
3,5-dichloro-6-hydrazinyl-N,N-dimethylpyridin-2-amine
CID 102762384
5-chloro-4-N-methyl-4-N-(1-methylsulfanylbutan-2-yl)pyrimidine-2,4-diamine
CID 112667834
3,5-dichloro-6-hydrazinyl-N-methyl-N-(2-methylpropyl)pyridin-2-amine
CID 102761612
3,5,6-trichloro-N-methyl-N-pentan-3-ylpyridin-2-amine
CID 102750408
6-chloro-2-N-methyl-2-N-(1-methylsulfanylbutan-2-yl)pyridine-2,3-diamine
CID 112656901
N-butan-2-yl-N-butyl-3,5-dichloro-6-hydrazinylpyridin-2-amine
CID 102761856
6-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)-5-nitropyrimidin-4-amine
CID 112668063
3,5-dichloro-2-N-ethyl-6-N-methyl-6-N-propan-2-ylpyridine-2,6-diamine
CID 102755335
3,5-dichloro-6-N-methyl-6-N-(4-methylsulfanylbutan-2-yl)-2-N-propylpyridine-2,6-diamine
CID 102760077
6-chloro-2-N-methyl-2-N-(1-methylsulfanylbutan-2-yl)pyridine-2,4-diamine
CID 104925205
2-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)-methylamino]acetamide
CID 102761628

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-6-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)pyridin-2-amine?
The IUPAC name of 3,5-dichloro-6-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)pyridin-2-amine (CID 102762521) is 3,5-dichloro-6-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)pyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-6-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)pyridin-2-amine?
The canonical SMILES for 3,5-dichloro-6-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)pyridin-2-amine is CCC(CSC)N(C)c1nc(NN)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-6-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)pyridin-2-amine?
The InChIKey is QPKDWIVWJQIQCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18Cl2N4S/c1-4-7(6-18-3)17(2)11-9(13)5-8(12)10(15-11)16-14/h5,7H,4,6,14H2,1-3H3,(H,15,16).
What are the key properties of 3,5-dichloro-6-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)pyridin-2-amine?
3,5-dichloro-6-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)pyridin-2-amine has a molecular weight of 309.27 g/mol, XLogP of 3.25, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-6-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)pyridin-2-amine is sourced from PubChem (CID 102762521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).