4-(cyclopropylsulfamoyl)-N-[3-(4-methylpiperidin-1-yl)propyl]benzamide

C19H29N3O3S — CID 18150983

IUPAC4-(cyclopropylsulfamoyl)-N-[3-(4-methylpiperidin-1-yl)propyl]benzamide
SMILESCC1CCN(CCCNC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)CC1
InChIInChI=1S/C19H29N3O3S/c1-15-9-13-22(14-10-15)12-2-11-20-19(23)16-3-7-18(8-4-16)26(24,25)21-17-5-6-17/h3-4,7-8,15,17,21H,2,5-6,9-14H2,1H3,(H,20,23)
InChIKeyKAGCXSKOYDWKKB-UHFFFAOYSA-N
MW379.53 g/mol
LogP1.98
Rot. Bonds8

About 4-(cyclopropylsulfamoyl)-N-[3-(4-methylpiperidin-1-yl)propyl]benzamide

4-(cyclopropylsulfamoyl)-N-[3-(4-methylpiperidin-1-yl)propyl]benzamide (PubChem CID 18150983) has the molecular formula C19H29N3O3S and a molecular weight of 379.53 g/mol. Its IUPAC name is 4-(cyclopropylsulfamoyl)-N-[3-(4-methylpiperidin-1-yl)propyl]benzamide.

Molecular Properties

Compound Name4-(cyclopropylsulfamoyl)-N-[3-(4-methylpiperidin-1-yl)propyl]benzamide
PubChem CID18150983
Molecular FormulaC19H29N3O3S
Molecular Weight379.53 g/mol
Exact Mass379.19
IUPAC Name4-(cyclopropylsulfamoyl)-N-[3-(4-methylpiperidin-1-yl)propyl]benzamide
SMILESCC1CCN(CCCNC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)CC1
InChIInChI=1S/C19H29N3O3S/c1-15-9-13-22(14-10-15)12-2-11-20-19(23)16-3-7-18(8-4-16)26(24,25)21-17-5-6-17/h3-4,7-8,15,17,21H,2,5-6,9-14H2,1H3,(H,20,23)
InChIKeyKAGCXSKOYDWKKB-UHFFFAOYSA-N
XLogP1.98
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.53
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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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-(2-piperazin-1-ylethyl)benzamide
CID 119447342
4-[(2-fluorophenyl)sulfamoyl]-N-[4-(4-methylpiperidin-1-yl)butyl]benzamide
CID 55724828
4-[3-(4-methylpiperidin-1-yl)propylsulfamoyl]-N-(2,2,2-trifluoroethyl)benzamide
CID 8844139
1-[[4-(cyclopropylsulfamoyl)phenyl]methyl]-2-methyl-3-[3-(4-methylpiperidin-1-yl)propyl]guanidine;hydroiodide
CID 111386653
4-(4-methylpiperidin-1-yl)sulfonyl-N-(3-morpholin-4-ylpropyl)benzamide
CID 8884155
4-[2-(methanesulfonamido)ethyl]-N-[3-(4-methylpiperidin-1-yl)propyl]benzamide
CID 30541364
4-(cyclopentylsulfamoyl)-N-(3-methoxypropyl)benzamide
CID 109059323
4-(cyclohexylsulfamoyl)-N-pentylbenzamide
CID 109059553
N-[3-(4-methylpiperidin-1-yl)propyl]-4-(5-methylpyrazol-1-yl)benzamide
CID 35417488
N-[3-(4-methylpiperidin-1-yl)propyl]-6-oxo-1H-pyridine-3-carboxamide
CID 30541274

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropylsulfamoyl)-N-[3-(4-methylpiperidin-1-yl)propyl]benzamide?
The IUPAC name of 4-(cyclopropylsulfamoyl)-N-[3-(4-methylpiperidin-1-yl)propyl]benzamide (CID 18150983) is 4-(cyclopropylsulfamoyl)-N-[3-(4-methylpiperidin-1-yl)propyl]benzamide.
What is the SMILES notation for 4-(cyclopropylsulfamoyl)-N-[3-(4-methylpiperidin-1-yl)propyl]benzamide?
The canonical SMILES for 4-(cyclopropylsulfamoyl)-N-[3-(4-methylpiperidin-1-yl)propyl]benzamide is CC1CCN(CCCNC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)CC1.
What is the InChIKey of 4-(cyclopropylsulfamoyl)-N-[3-(4-methylpiperidin-1-yl)propyl]benzamide?
The InChIKey is KAGCXSKOYDWKKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O3S/c1-15-9-13-22(14-10-15)12-2-11-20-19(23)16-3-7-18(8-4-16)26(24,25)21-17-5-6-17/h3-4,7-8,15,17,21H,2,5-6,9-14H2,1H3,(H,20,23).
What are the key properties of 4-(cyclopropylsulfamoyl)-N-[3-(4-methylpiperidin-1-yl)propyl]benzamide?
4-(cyclopropylsulfamoyl)-N-[3-(4-methylpiperidin-1-yl)propyl]benzamide has a molecular weight of 379.53 g/mol, XLogP of 1.98, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylsulfamoyl)-N-[3-(4-methylpiperidin-1-yl)propyl]benzamide is sourced from PubChem (CID 18150983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).