5-chloro-N-[2-(dimethylamino)ethyl]-6-hydrazinyl-N-methylpyridine-3-sulfonamide

C10H18ClN5O2S — CID 64608007

IUPAC5-chloro-N-[2-(dimethylamino)ethyl]-6-hydrazinyl-N-methylpyridine-3-sulfonamide
SMILESCN(C)CCN(C)S(=O)(=O)c1cnc(NN)c(Cl)c1
InChIInChI=1S/C10H18ClN5O2S/c1-15(2)4-5-16(3)19(17,18)8-6-9(11)10(14-12)13-7-8/h6-7H,4-5,12H2,1-3H3,(H,13,14)
InChIKeySIFNFWHQYSDWNF-UHFFFAOYSA-N
MW307.81 g/mol
LogP0.20
Rot. Bonds6

About 5-chloro-N-[2-(dimethylamino)ethyl]-6-hydrazinyl-N-methylpyridine-3-sulfonamide

5-chloro-N-[2-(dimethylamino)ethyl]-6-hydrazinyl-N-methylpyridine-3-sulfonamide (PubChem CID 64608007) has the molecular formula C10H18ClN5O2S and a molecular weight of 307.81 g/mol. Its IUPAC name is 5-chloro-N-[2-(dimethylamino)ethyl]-6-hydrazinyl-N-methylpyridine-3-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-[2-(dimethylamino)ethyl]-6-hydrazinyl-N-methylpyridine-3-sulfonamide
PubChem CID64608007
Molecular FormulaC10H18ClN5O2S
Molecular Weight307.81 g/mol
Exact Mass307.09
IUPAC Name5-chloro-N-[2-(dimethylamino)ethyl]-6-hydrazinyl-N-methylpyridine-3-sulfonamide
SMILESCN(C)CCN(C)S(=O)(=O)c1cnc(NN)c(Cl)c1
InChIInChI=1S/C10H18ClN5O2S/c1-15(2)4-5-16(3)19(17,18)8-6-9(11)10(14-12)13-7-8/h6-7H,4-5,12H2,1-3H3,(H,13,14)
InChIKeySIFNFWHQYSDWNF-UHFFFAOYSA-N
XLogP0.20
TPSA91.56 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.81
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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

5-chloro-6-hydrazinyl-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-3-sulfonamide
CID 64608776
5-chloro-6-hydrazinyl-N-methyl-N-[(2-methylcyclopropyl)methyl]pyridine-3-sulfonamide
CID 64608963
5-chloro-N-(2-cyanopropyl)-6-hydrazinyl-N-methylpyridine-3-sulfonamide
CID 64608758
5-chloro-6-hydrazinyl-N-methyl-N-(4-methylpentan-2-yl)pyridine-3-sulfonamide
CID 64606467
ethyl 2-[(5-chloro-6-hydrazinyl-3-pyridinyl)sulfonyl-methylamino]acetate;ethyl 2-[(5,6-dichloro-3-pyridinyl)sulfonyl-methylamino]acetate
CID 160881864
5-chloro-6-hydrazinyl-N-methyl-N-pyridin-4-ylpyridine-3-sulfonamide
CID 106936239
5-chloro-6-hydrazinyl-N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide
CID 107480756
5-chloro-N,N-bis(cyanomethyl)-6-hydrazinylpyridine-3-sulfonamide
CID 64607392
5-chloro-6-hydrazinyl-N-propylpyridine-3-sulfonamide
CID 64607208
5-chloro-N-[(3S)-3-hydroxybutyl]-N-methyl-6-(2-methylpropylamino)pyridine-3-sulfonamide
CID 164640112
5-chloro-N-[3-(dimethylamino)propyl]-N-ethyl-6-(methylamino)pyridine-3-sulfonamide
CID 102996715
5-chloro-N,N-dimethyl-6-(methylamino)pyridine-3-sulfonamide
CID 64607736

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[2-(dimethylamino)ethyl]-6-hydrazinyl-N-methylpyridine-3-sulfonamide?
The IUPAC name of 5-chloro-N-[2-(dimethylamino)ethyl]-6-hydrazinyl-N-methylpyridine-3-sulfonamide (CID 64608007) is 5-chloro-N-[2-(dimethylamino)ethyl]-6-hydrazinyl-N-methylpyridine-3-sulfonamide.
What is the SMILES notation for 5-chloro-N-[2-(dimethylamino)ethyl]-6-hydrazinyl-N-methylpyridine-3-sulfonamide?
The canonical SMILES for 5-chloro-N-[2-(dimethylamino)ethyl]-6-hydrazinyl-N-methylpyridine-3-sulfonamide is CN(C)CCN(C)S(=O)(=O)c1cnc(NN)c(Cl)c1.
What is the InChIKey of 5-chloro-N-[2-(dimethylamino)ethyl]-6-hydrazinyl-N-methylpyridine-3-sulfonamide?
The InChIKey is SIFNFWHQYSDWNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18ClN5O2S/c1-15(2)4-5-16(3)19(17,18)8-6-9(11)10(14-12)13-7-8/h6-7H,4-5,12H2,1-3H3,(H,13,14).
What are the key properties of 5-chloro-N-[2-(dimethylamino)ethyl]-6-hydrazinyl-N-methylpyridine-3-sulfonamide?
5-chloro-N-[2-(dimethylamino)ethyl]-6-hydrazinyl-N-methylpyridine-3-sulfonamide has a molecular weight of 307.81 g/mol, XLogP of 0.20, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[2-(dimethylamino)ethyl]-6-hydrazinyl-N-methylpyridine-3-sulfonamide is sourced from PubChem (CID 64608007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).