N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-(cyclopropylsulfamoyl)benzamide

C19H25N3O4S — CID 46540127

IUPACN-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-(cyclopropylsulfamoyl)benzamide
SMILESO=C(NC1CCN(C(=O)C2CC2)CC1)c1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C19H25N3O4S/c23-18(20-15-9-11-22(12-10-15)19(24)14-1-2-14)13-3-7-17(8-4-13)27(25,26)21-16-5-6-16/h3-4,7-8,14-16,21H,1-2,5-6,9-12H2,(H,20,23)
InChIKeyDYWHJLVUPGOMTD-UHFFFAOYSA-N
MW391.49 g/mol
LogP1.26
Rot. Bonds6

About N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-(cyclopropylsulfamoyl)benzamide

N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-(cyclopropylsulfamoyl)benzamide (PubChem CID 46540127) has the molecular formula C19H25N3O4S and a molecular weight of 391.49 g/mol. Its IUPAC name is N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-(cyclopropylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-(cyclopropylsulfamoyl)benzamide
PubChem CID46540127
Molecular FormulaC19H25N3O4S
Molecular Weight391.49 g/mol
Exact Mass391.16
IUPAC NameN-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-(cyclopropylsulfamoyl)benzamide
SMILESO=C(NC1CCN(C(=O)C2CC2)CC1)c1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C19H25N3O4S/c23-18(20-15-9-11-22(12-10-15)19(24)14-1-2-14)13-3-7-17(8-4-13)27(25,26)21-16-5-6-16/h3-4,7-8,14-16,21H,1-2,5-6,9-12H2,(H,20,23)
InChIKeyDYWHJLVUPGOMTD-UHFFFAOYSA-N
XLogP1.26
TPSA95.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.49
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-3-(cyclopropylsulfamoyl)benzamide
CID 55690965
N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-methoxybenzenesulfonamide
CID 50823745
N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-4-[(4-methylphenyl)sulfamoyl]benzamide
CID 46454888
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-(cyclopropylsulfamoyl)benzamide
CID 18278929
N-phenyl-4-[[4-(phenylsulfamoyl)benzoyl]amino]piperidine-1-carboxamide
CID 46537325
N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-4-[methoxy(methyl)sulfamoyl]benzamide
CID 46463867
N-cyclopropyl-4-[4-[(2S,6R)-2,6-dimethylmorpholine-4-carbonyl]piperidine-1-carbonyl]benzenesulfonamide
CID 38935844
N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-4-(3,5-dimethylpiperidin-1-yl)sulfonylbenzamide
CID 55690874
4-(cyclopropylsulfamoyl)-N-(1,1-dioxothiolan-3-yl)benzamide
CID 109058398
N-[1-(cyclobutanecarbonyl)piperidin-4-yl]-4-phenylbenzamide
CID 52898200
4-[4-(benzenesulfonamido)piperidin-1-yl]-N-cyclopropyl-3-nitrobenzamide
CID 26031798
N-[3-(azepan-1-yl)propyl]-4-(cyclopropylsulfamoyl)benzamide
CID 30942685

Frequently Asked Questions

What is the IUPAC name of N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-(cyclopropylsulfamoyl)benzamide?
The IUPAC name of N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-(cyclopropylsulfamoyl)benzamide (CID 46540127) is N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-(cyclopropylsulfamoyl)benzamide.
What is the SMILES notation for N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-(cyclopropylsulfamoyl)benzamide?
The canonical SMILES for N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-(cyclopropylsulfamoyl)benzamide is O=C(NC1CCN(C(=O)C2CC2)CC1)c1ccc(S(=O)(=O)NC2CC2)cc1.
What is the InChIKey of N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-(cyclopropylsulfamoyl)benzamide?
The InChIKey is DYWHJLVUPGOMTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O4S/c23-18(20-15-9-11-22(12-10-15)19(24)14-1-2-14)13-3-7-17(8-4-13)27(25,26)21-16-5-6-16/h3-4,7-8,14-16,21H,1-2,5-6,9-12H2,(H,20,23).
What are the key properties of N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-(cyclopropylsulfamoyl)benzamide?
N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-(cyclopropylsulfamoyl)benzamide has a molecular weight of 391.49 g/mol, XLogP of 1.26, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-(cyclopropylsulfamoyl)benzamide is sourced from PubChem (CID 46540127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).