N-[2-(dimethylamino)ethyl]-2-hydrazinylpyrimidine-5-sulfonamide

C8H16N6O2S — CID 61327931

IUPACN-[2-(dimethylamino)ethyl]-2-hydrazinylpyrimidine-5-sulfonamide
SMILESCN(C)CCNS(=O)(=O)c1cnc(NN)nc1
InChIInChI=1S/C8H16N6O2S/c1-14(2)4-3-12-17(15,16)7-5-10-8(13-9)11-6-7/h5-6,12H,3-4,9H2,1-2H3,(H,10,11,13)
InChIKeyVCKSJEXWFYOCCI-UHFFFAOYSA-N
MW260.32 g/mol
LogP-1.40
Rot. Bonds6

About N-[2-(dimethylamino)ethyl]-2-hydrazinylpyrimidine-5-sulfonamide

N-[2-(dimethylamino)ethyl]-2-hydrazinylpyrimidine-5-sulfonamide (PubChem CID 61327931) has the molecular formula C8H16N6O2S and a molecular weight of 260.32 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-2-hydrazinylpyrimidine-5-sulfonamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-2-hydrazinylpyrimidine-5-sulfonamide
PubChem CID61327931
Molecular FormulaC8H16N6O2S
Molecular Weight260.32 g/mol
Exact Mass260.11
IUPAC NameN-[2-(dimethylamino)ethyl]-2-hydrazinylpyrimidine-5-sulfonamide
SMILESCN(C)CCNS(=O)(=O)c1cnc(NN)nc1
InChIInChI=1S/C8H16N6O2S/c1-14(2)4-3-12-17(15,16)7-5-10-8(13-9)11-6-7/h5-6,12H,3-4,9H2,1-2H3,(H,10,11,13)
InChIKeyVCKSJEXWFYOCCI-UHFFFAOYSA-N
XLogP-1.40
TPSA113.24 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.32
LogP ≤ 5-1.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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

2-amino-N-[2-(dimethylamino)ethyl]pyrimidine-5-sulfonamide
CID 62149164
N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-hydrazinylpyrimidine-5-sulfonamide
CID 61329687
2-hydrazinyl-N-(4-methylpentyl)pyrimidine-5-sulfonamide
CID 63004596
2-hydrazinyl-N-(3,3,3-trifluoropropyl)pyrimidine-5-sulfonamide
CID 63227725
5-[2-(dimethylamino)ethylsulfamoyl]pyridine-2-carbothioamide
CID 114613962
N-[2-[2-methoxyethyl(methyl)amino]ethyl]-2-(methylamino)pyrimidine-5-sulfonamide
CID 62850113
6-amino-N-[2-(dimethylamino)ethyl]-5-nitropyridine-3-sulfonamide
CID 82222955
2-hydrazinyl-N-[(4-methylphenyl)methyl]pyrimidine-5-sulfonamide
CID 61328911
5-bromo-N-[2-(dimethylamino)ethyl]-2-hydrazinylpyridine-3-sulfonamide
CID 61299692
2-hydrazinyl-N-(2-pyridin-2-ylethyl)pyrimidine-5-sulfonamide
CID 61328516
2-hydrazinyl-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidine-5-sulfonamide
CID 63823602
N-[2-(dimethylamino)ethyl]-4-ethoxybenzenesulfonamide
CID 7528966

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-2-hydrazinylpyrimidine-5-sulfonamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-2-hydrazinylpyrimidine-5-sulfonamide (CID 61327931) is N-[2-(dimethylamino)ethyl]-2-hydrazinylpyrimidine-5-sulfonamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-2-hydrazinylpyrimidine-5-sulfonamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-2-hydrazinylpyrimidine-5-sulfonamide is CN(C)CCNS(=O)(=O)c1cnc(NN)nc1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-2-hydrazinylpyrimidine-5-sulfonamide?
The InChIKey is VCKSJEXWFYOCCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N6O2S/c1-14(2)4-3-12-17(15,16)7-5-10-8(13-9)11-6-7/h5-6,12H,3-4,9H2,1-2H3,(H,10,11,13).
What are the key properties of N-[2-(dimethylamino)ethyl]-2-hydrazinylpyrimidine-5-sulfonamide?
N-[2-(dimethylamino)ethyl]-2-hydrazinylpyrimidine-5-sulfonamide has a molecular weight of 260.32 g/mol, XLogP of -1.40, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-2-hydrazinylpyrimidine-5-sulfonamide is sourced from PubChem (CID 61327931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).