5-(hydrazinecarbonyl)-N,N-dipropyl-1H-pyrrole-3-sulfonamide

C11H20N4O3S — CID 16780236

IUPAC5-(hydrazinecarbonyl)-N,N-dipropyl-1H-pyrrole-3-sulfonamide
SMILESCCCN(CCC)S(=O)(=O)c1c[nH]c(C(=O)NN)c1
InChIInChI=1S/C11H20N4O3S/c1-3-5-15(6-4-2)19(17,18)9-7-10(13-8-9)11(16)14-12/h7-8,13H,3-6,12H2,1-2H3,(H,14,16)
InChIKeyWUEAWFNILVVQSS-UHFFFAOYSA-N
MW288.37 g/mol
LogP0.43
Rot. Bonds7

About 5-(hydrazinecarbonyl)-N,N-dipropyl-1H-pyrrole-3-sulfonamide

5-(hydrazinecarbonyl)-N,N-dipropyl-1H-pyrrole-3-sulfonamide (PubChem CID 16780236) has the molecular formula C11H20N4O3S and a molecular weight of 288.37 g/mol. Its IUPAC name is 5-(hydrazinecarbonyl)-N,N-dipropyl-1H-pyrrole-3-sulfonamide.

Molecular Properties

Compound Name5-(hydrazinecarbonyl)-N,N-dipropyl-1H-pyrrole-3-sulfonamide
PubChem CID16780236
Molecular FormulaC11H20N4O3S
Molecular Weight288.37 g/mol
Exact Mass288.13
IUPAC Name5-(hydrazinecarbonyl)-N,N-dipropyl-1H-pyrrole-3-sulfonamide
SMILESCCCN(CCC)S(=O)(=O)c1c[nH]c(C(=O)NN)c1
InChIInChI=1S/C11H20N4O3S/c1-3-5-15(6-4-2)19(17,18)9-7-10(13-8-9)11(16)14-12/h7-8,13H,3-6,12H2,1-2H3,(H,14,16)
InChIKeyWUEAWFNILVVQSS-UHFFFAOYSA-N
XLogP0.43
TPSA108.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.37
LogP ≤ 50.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5-(hydrazinecarbonyl)-N,N-dimethyl-1H-pyrrole-3-sulfonamide
CID 16780083
5-(hydrazinecarbonyl)-N-methyl-N-phenyl-1H-pyrrole-3-sulfonamide
CID 16779931
4-(diethylsulfamoyl)-N-(4-hydroxybutan-2-yl)-1H-pyrrole-2-carboxamide
CID 115283401
N-propyl-4-sulfamoyl-1H-pyrrole-2-carboxamide
CID 65375918
4-(4-methylpiperazin-1-yl)sulfonyl-1H-pyrrole-2-carbohydrazide
CID 16780082
4-[cyclopropyl(propyl)sulfamoyl]-1H-pyrrole-2-carboxylic acid
CID 43270298
4-(dipropylsulfamoyl)-N-(2-hydrazinyl-2-oxoethyl)benzamide
CID 43948656
4-[ethyl-(2-methoxy-2-oxoethyl)sulfamoyl]-1H-pyrrole-2-carboxylic acid
CID 54997976
4-[bis(2-cyanoethyl)sulfamoyl]-1H-pyrrole-2-carboxylic acid
CID 43311208
4-[2-methoxyethyl(methyl)sulfamoyl]-1H-pyrrole-2-carboxylic acid
CID 61042051
N-pentyl-4-sulfamoyl-1H-pyrrole-2-carboxamide
CID 65375173
N-(4-fluorophenyl)-5-(hydrazinecarbonyl)-1H-pyrrole-3-sulfonamide
CID 16780201

Frequently Asked Questions

What is the IUPAC name of 5-(hydrazinecarbonyl)-N,N-dipropyl-1H-pyrrole-3-sulfonamide?
The IUPAC name of 5-(hydrazinecarbonyl)-N,N-dipropyl-1H-pyrrole-3-sulfonamide (CID 16780236) is 5-(hydrazinecarbonyl)-N,N-dipropyl-1H-pyrrole-3-sulfonamide.
What is the SMILES notation for 5-(hydrazinecarbonyl)-N,N-dipropyl-1H-pyrrole-3-sulfonamide?
The canonical SMILES for 5-(hydrazinecarbonyl)-N,N-dipropyl-1H-pyrrole-3-sulfonamide is CCCN(CCC)S(=O)(=O)c1c[nH]c(C(=O)NN)c1.
What is the InChIKey of 5-(hydrazinecarbonyl)-N,N-dipropyl-1H-pyrrole-3-sulfonamide?
The InChIKey is WUEAWFNILVVQSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O3S/c1-3-5-15(6-4-2)19(17,18)9-7-10(13-8-9)11(16)14-12/h7-8,13H,3-6,12H2,1-2H3,(H,14,16).
What are the key properties of 5-(hydrazinecarbonyl)-N,N-dipropyl-1H-pyrrole-3-sulfonamide?
5-(hydrazinecarbonyl)-N,N-dipropyl-1H-pyrrole-3-sulfonamide has a molecular weight of 288.37 g/mol, XLogP of 0.43, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(hydrazinecarbonyl)-N,N-dipropyl-1H-pyrrole-3-sulfonamide is sourced from PubChem (CID 16780236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).