3-[4-(cyclopropylsulfamoyl)phenyl]-N-piperidin-3-ylpropanamide;hydrochloride

C17H26ClN3O3S — CID 119424393

IUPAC3-[4-(cyclopropylsulfamoyl)phenyl]-N-piperidin-3-ylpropanamide;hydrochloride
SMILESCl.O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NC1CCCNC1
InChIInChI=1S/C17H25N3O3S.ClH/c21-17(19-15-2-1-11-18-12-15)10-5-13-3-8-16(9-4-13)24(22,23)20-14-6-7-14;/h3-4,8-9,14-15,18,20H,1-2,5-7,10-12H2,(H,19,21);1H
InChIKeyGRKFPYLHXUSEFH-UHFFFAOYSA-N
MW387.93 g/mol
LogP1.35
Rot. Bonds7

About 3-[4-(cyclopropylsulfamoyl)phenyl]-N-piperidin-3-ylpropanamide;hydrochloride

3-[4-(cyclopropylsulfamoyl)phenyl]-N-piperidin-3-ylpropanamide;hydrochloride (PubChem CID 119424393) has the molecular formula C17H26ClN3O3S and a molecular weight of 387.93 g/mol. Its IUPAC name is 3-[4-(cyclopropylsulfamoyl)phenyl]-N-piperidin-3-ylpropanamide;hydrochloride.

Molecular Properties

Compound Name3-[4-(cyclopropylsulfamoyl)phenyl]-N-piperidin-3-ylpropanamide;hydrochloride
PubChem CID119424393
Molecular FormulaC17H26ClN3O3S
Molecular Weight387.93 g/mol
Exact Mass387.14
IUPAC Name3-[4-(cyclopropylsulfamoyl)phenyl]-N-piperidin-3-ylpropanamide;hydrochloride
SMILESCl.O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NC1CCCNC1
InChIInChI=1S/C17H25N3O3S.ClH/c21-17(19-15-2-1-11-18-12-15)10-5-13-3-8-16(9-4-13)24(22,23)20-14-6-7-14;/h3-4,8-9,14-15,18,20H,1-2,5-7,10-12H2,(H,19,21);1H
InChIKeyGRKFPYLHXUSEFH-UHFFFAOYSA-N
XLogP1.35
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.93
LogP ≤ 51.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-[4-(azepan-1-ylsulfonyl)phenyl]-N-piperidin-3-ylpropanamide
CID 119424951
N-pyrrolidin-3-yl-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide;hydrochloride
CID 119450219
3-[4-(cyclopentylsulfamoyl)phenyl]-N-[2-(cyclopropylamino)-2-oxoethyl]propanamide
CID 110353893
3-(4-piperidin-1-ylsulfonylphenyl)-N-pyrrolidin-3-ylpropanamide
CID 119450862
N-piperidin-3-yl-3-(4-propoxyphenyl)propanamide;hydrochloride
CID 119427303
3-[4-(cyclohexylsulfamoyl)phenyl]propanoate
CID 7330268
4-(2-methylpropyl)-N-piperidin-3-ylbenzenesulfonamide;hydrochloride
CID 119964495
N-piperidin-3-yl-2-(4-piperidin-1-ylsulfonylphenyl)acetamide;hydrochloride
CID 119425534
N-cyclooctyl-3-[4-(methylsulfamoyl)phenyl]propanamide
CID 51180741
2-[4-(difluoromethylsulfonyl)phenyl]-N-piperidin-3-ylacetamide
CID 119426046
3-[4-(cyclohexylsulfamoyl)phenyl]-N-(4-fluorophenyl)propanamide
CID 126248632
3-[(4-nitrophenyl)sulfonylamino]-N-piperidin-3-ylpropanamide
CID 119425175

Frequently Asked Questions

What is the IUPAC name of 3-[4-(cyclopropylsulfamoyl)phenyl]-N-piperidin-3-ylpropanamide;hydrochloride?
The IUPAC name of 3-[4-(cyclopropylsulfamoyl)phenyl]-N-piperidin-3-ylpropanamide;hydrochloride (CID 119424393) is 3-[4-(cyclopropylsulfamoyl)phenyl]-N-piperidin-3-ylpropanamide;hydrochloride.
What is the SMILES notation for 3-[4-(cyclopropylsulfamoyl)phenyl]-N-piperidin-3-ylpropanamide;hydrochloride?
The canonical SMILES for 3-[4-(cyclopropylsulfamoyl)phenyl]-N-piperidin-3-ylpropanamide;hydrochloride is Cl.O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NC1CCCNC1.
What is the InChIKey of 3-[4-(cyclopropylsulfamoyl)phenyl]-N-piperidin-3-ylpropanamide;hydrochloride?
The InChIKey is GRKFPYLHXUSEFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O3S.ClH/c21-17(19-15-2-1-11-18-12-15)10-5-13-3-8-16(9-4-13)24(22,23)20-14-6-7-14;/h3-4,8-9,14-15,18,20H,1-2,5-7,10-12H2,(H,19,21);1H.
What are the key properties of 3-[4-(cyclopropylsulfamoyl)phenyl]-N-piperidin-3-ylpropanamide;hydrochloride?
3-[4-(cyclopropylsulfamoyl)phenyl]-N-piperidin-3-ylpropanamide;hydrochloride has a molecular weight of 387.93 g/mol, XLogP of 1.35, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(cyclopropylsulfamoyl)phenyl]-N-piperidin-3-ylpropanamide;hydrochloride is sourced from PubChem (CID 119424393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).