4-(cyclopropylsulfamoyl)-N-(2-piperazin-1-ylethyl)benzamide

C16H24N4O3S — CID 119447342

IUPAC4-(cyclopropylsulfamoyl)-N-(2-piperazin-1-ylethyl)benzamide
SMILESO=C(NCCN1CCNCC1)c1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C16H24N4O3S/c21-16(18-9-12-20-10-7-17-8-11-20)13-1-5-15(6-2-13)24(22,23)19-14-3-4-14/h1-2,5-6,14,17,19H,3-4,7-12H2,(H,18,21)
InChIKeySBQBLNCOQOZXOJ-UHFFFAOYSA-N
MW352.46 g/mol
LogP-0.24
Rot. Bonds7

About 4-(cyclopropylsulfamoyl)-N-(2-piperazin-1-ylethyl)benzamide

4-(cyclopropylsulfamoyl)-N-(2-piperazin-1-ylethyl)benzamide (PubChem CID 119447342) has the molecular formula C16H24N4O3S and a molecular weight of 352.46 g/mol. Its IUPAC name is 4-(cyclopropylsulfamoyl)-N-(2-piperazin-1-ylethyl)benzamide.

Molecular Properties

Compound Name4-(cyclopropylsulfamoyl)-N-(2-piperazin-1-ylethyl)benzamide
PubChem CID119447342
Molecular FormulaC16H24N4O3S
Molecular Weight352.46 g/mol
Exact Mass352.16
IUPAC Name4-(cyclopropylsulfamoyl)-N-(2-piperazin-1-ylethyl)benzamide
SMILESO=C(NCCN1CCNCC1)c1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C16H24N4O3S/c21-16(18-9-12-20-10-7-17-8-11-20)13-1-5-15(6-2-13)24(22,23)19-14-3-4-14/h1-2,5-6,14,17,19H,3-4,7-12H2,(H,18,21)
InChIKeySBQBLNCOQOZXOJ-UHFFFAOYSA-N
XLogP-0.24
TPSA90.54 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.46
LogP ≤ 5-0.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(azepan-1-yl)propyl]-4-(cyclopropylsulfamoyl)benzamide
CID 30942685
4-(cyclopropylsulfamoyl)-N-[2-(3,5-dimethylpiperidin-1-yl)ethyl]benzamide
CID 55723380
4-(cyclopropylsulfamoyl)-N-[3-(4-methylpiperidin-1-yl)propyl]benzamide
CID 18150983
4-(2-methoxyethylsulfamoyl)-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride
CID 119446751
4-fluoro-N-(2-piperazin-1-ylethyl)benzamide
CID 10753244
4-[2-(dimethylamino)-2-oxoethyl]sulfonyl-N-(2-piperazin-1-ylethyl)benzamide
CID 119448151
N-[2-[[4-(cyclopropylsulfamoyl)benzoyl]amino]ethyl]-4-(trifluoromethyl)benzamide
CID 34508335
N-[2-(dimethylamino)ethyl]-4-[[(3R)-pyrrolidin-3-yl]sulfamoyl]benzamide
CID 70720005
4-(methylaminomethyl)-N-(2-piperazin-1-ylethyl)benzamide
CID 90338095
4-(diethylsulfamoyl)-N-(3-piperazin-1-ylpropyl)benzamide
CID 119392771
4-(cyclopropylsulfamoyl)-N-[(4-fluorophenyl)methyl]benzamide
CID 17496581
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-(cyclopropylsulfamoyl)benzamide
CID 18278929

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropylsulfamoyl)-N-(2-piperazin-1-ylethyl)benzamide?
The IUPAC name of 4-(cyclopropylsulfamoyl)-N-(2-piperazin-1-ylethyl)benzamide (CID 119447342) is 4-(cyclopropylsulfamoyl)-N-(2-piperazin-1-ylethyl)benzamide.
What is the SMILES notation for 4-(cyclopropylsulfamoyl)-N-(2-piperazin-1-ylethyl)benzamide?
The canonical SMILES for 4-(cyclopropylsulfamoyl)-N-(2-piperazin-1-ylethyl)benzamide is O=C(NCCN1CCNCC1)c1ccc(S(=O)(=O)NC2CC2)cc1.
What is the InChIKey of 4-(cyclopropylsulfamoyl)-N-(2-piperazin-1-ylethyl)benzamide?
The InChIKey is SBQBLNCOQOZXOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O3S/c21-16(18-9-12-20-10-7-17-8-11-20)13-1-5-15(6-2-13)24(22,23)19-14-3-4-14/h1-2,5-6,14,17,19H,3-4,7-12H2,(H,18,21).
What are the key properties of 4-(cyclopropylsulfamoyl)-N-(2-piperazin-1-ylethyl)benzamide?
4-(cyclopropylsulfamoyl)-N-(2-piperazin-1-ylethyl)benzamide has a molecular weight of 352.46 g/mol, XLogP of -0.24, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylsulfamoyl)-N-(2-piperazin-1-ylethyl)benzamide is sourced from PubChem (CID 119447342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).