3-(cyclopropylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide;hydrochloride

C16H24ClN3O3S — CID 119460525

IUPAC3-(cyclopropylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
SMILESCl.O=C(NCC1CCCNC1)c1cccc(S(=O)(=O)NC2CC2)c1
InChIInChI=1S/C16H23N3O3S.ClH/c20-16(18-11-12-3-2-8-17-10-12)13-4-1-5-15(9-13)23(21,22)19-14-6-7-14;/h1,4-5,9,12,14,17,19H,2-3,6-8,10-11H2,(H,18,20);1H
InChIKeyKFYDHWUNDUTYKT-UHFFFAOYSA-N
MW373.91 g/mol
LogP1.28
Rot. Bonds6

About 3-(cyclopropylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide;hydrochloride

3-(cyclopropylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide;hydrochloride (PubChem CID 119460525) has the molecular formula C16H24ClN3O3S and a molecular weight of 373.91 g/mol. Its IUPAC name is 3-(cyclopropylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide;hydrochloride.

Molecular Properties

Compound Name3-(cyclopropylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
PubChem CID119460525
Molecular FormulaC16H24ClN3O3S
Molecular Weight373.91 g/mol
Exact Mass373.12
IUPAC Name3-(cyclopropylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
SMILESCl.O=C(NCC1CCCNC1)c1cccc(S(=O)(=O)NC2CC2)c1
InChIInChI=1S/C16H23N3O3S.ClH/c20-16(18-11-12-3-2-8-17-10-12)13-4-1-5-15(9-13)23(21,22)19-14-6-7-14;/h1,4-5,9,12,14,17,19H,2-3,6-8,10-11H2,(H,18,20);1H
InChIKeyKFYDHWUNDUTYKT-UHFFFAOYSA-N
XLogP1.28
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.91
LogP ≤ 51.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(piperidin-3-ylmethyl)-3-piperidin-1-ylsulfonylbenzamide;hydrochloride
CID 119463506
3-[methyl(propan-2-yl)sulfamoyl]-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119462288
3-(cyclopentylsulfamoyl)-N-[(4-hydroxypyrrolidin-3-yl)methyl]benzamide;hydrochloride
CID 120946036
3-(cyclopentylsulfamoyl)-N-(pyrrolidin-2-ylmethyl)benzamide
CID 119509919
3-(cyclopropylmethylsulfamoyl)-N-(2-piperidin-3-ylethyl)benzamide
CID 119558611
3-(cyclopentylsulfamoyl)-N-piperidin-3-ylbenzamide
CID 119424342
3-(cyclopropylsulfamoyl)-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119450174
3-N-(piperidin-3-ylmethyl)benzene-1,3-dicarboxamide;hydrochloride
CID 119463124
N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119461032
3-(2-methylpiperidin-1-yl)sulfonyl-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119463606
3-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-(piperidin-3-ylmethyl)benzamide
CID 119462393
3-acetyl-N-piperidin-3-ylbenzenesulfonamide;hydrochloride
CID 119964549

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide;hydrochloride?
The IUPAC name of 3-(cyclopropylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide;hydrochloride (CID 119460525) is 3-(cyclopropylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide;hydrochloride.
What is the SMILES notation for 3-(cyclopropylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide;hydrochloride?
The canonical SMILES for 3-(cyclopropylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide;hydrochloride is Cl.O=C(NCC1CCCNC1)c1cccc(S(=O)(=O)NC2CC2)c1.
What is the InChIKey of 3-(cyclopropylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide;hydrochloride?
The InChIKey is KFYDHWUNDUTYKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O3S.ClH/c20-16(18-11-12-3-2-8-17-10-12)13-4-1-5-15(9-13)23(21,22)19-14-6-7-14;/h1,4-5,9,12,14,17,19H,2-3,6-8,10-11H2,(H,18,20);1H.
What are the key properties of 3-(cyclopropylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide;hydrochloride?
3-(cyclopropylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide;hydrochloride has a molecular weight of 373.91 g/mol, XLogP of 1.28, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide;hydrochloride is sourced from PubChem (CID 119460525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).