4-(cyclopropylsulfamoyl)-N-[2-(diethylamino)propyl]benzamide

C17H27N3O3S — CID 46433043

IUPAC4-(cyclopropylsulfamoyl)-N-[2-(diethylamino)propyl]benzamide
SMILESCCN(CC)C(C)CNC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C17H27N3O3S/c1-4-20(5-2)13(3)12-18-17(21)14-6-10-16(11-7-14)24(22,23)19-15-8-9-15/h6-7,10-11,13,15,19H,4-5,8-9,12H2,1-3H3,(H,18,21)
InChIKeyDQIAKDRRXBZBNY-UHFFFAOYSA-N
MW353.49 g/mol
LogP1.59
Rot. Bonds9

About 4-(cyclopropylsulfamoyl)-N-[2-(diethylamino)propyl]benzamide

4-(cyclopropylsulfamoyl)-N-[2-(diethylamino)propyl]benzamide (PubChem CID 46433043) has the molecular formula C17H27N3O3S and a molecular weight of 353.49 g/mol. Its IUPAC name is 4-(cyclopropylsulfamoyl)-N-[2-(diethylamino)propyl]benzamide.

Molecular Properties

Compound Name4-(cyclopropylsulfamoyl)-N-[2-(diethylamino)propyl]benzamide
PubChem CID46433043
Molecular FormulaC17H27N3O3S
Molecular Weight353.49 g/mol
Exact Mass353.18
IUPAC Name4-(cyclopropylsulfamoyl)-N-[2-(diethylamino)propyl]benzamide
SMILESCCN(CC)C(C)CNC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C17H27N3O3S/c1-4-20(5-2)13(3)12-18-17(21)14-6-10-16(11-7-14)24(22,23)19-15-8-9-15/h6-7,10-11,13,15,19H,4-5,8-9,12H2,1-3H3,(H,18,21)
InChIKeyDQIAKDRRXBZBNY-UHFFFAOYSA-N
XLogP1.59
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.49
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(diethylamino)propyl]-4-(ethylsulfamoyl)benzamide
CID 46432829
N-[2-(diethylamino)propyl]-4-pyrrolidin-1-ylsulfonylbenzamide
CID 46432914
2-[[4-(cyclopropylsulfamoyl)benzoyl]-propan-2-ylamino]acetic acid
CID 119123974
N-(2-amino-2-methylpropyl)-4-(cyclopropylsulfamoyl)benzamide
CID 119628503
N-[3-(butan-2-ylamino)-3-oxopropyl]-4-(cyclopropylsulfamoyl)benzamide
CID 47067351
4-(cycloheptylsulfamoyl)-N-(3-methylbutyl)benzamide
CID 109061209
N-cyclopropyl-4-(2-methylpropanoyl)benzenesulfonamide
CID 82164865
2-[[4-(cyclopropylsulfamoyl)benzoyl]amino]-2-methylbutanoic acid
CID 119199013
N-[2-[[4-(cyclopropylsulfamoyl)benzoyl]amino]ethyl]-4-(trifluoromethyl)benzamide
CID 34508335
N-[2-(diethylamino)propyl]-4-(1,3-dithiolan-2-yl)benzamide
CID 86981262
4-(cyclohexylsulfamoyl)-N-pentylbenzamide
CID 109059553
N-[2-[(2R)-butan-2-yl]phenyl]-4-(cyclopropylsulfamoyl)benzamide
CID 40819169

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropylsulfamoyl)-N-[2-(diethylamino)propyl]benzamide?
The IUPAC name of 4-(cyclopropylsulfamoyl)-N-[2-(diethylamino)propyl]benzamide (CID 46433043) is 4-(cyclopropylsulfamoyl)-N-[2-(diethylamino)propyl]benzamide.
What is the SMILES notation for 4-(cyclopropylsulfamoyl)-N-[2-(diethylamino)propyl]benzamide?
The canonical SMILES for 4-(cyclopropylsulfamoyl)-N-[2-(diethylamino)propyl]benzamide is CCN(CC)C(C)CNC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1.
What is the InChIKey of 4-(cyclopropylsulfamoyl)-N-[2-(diethylamino)propyl]benzamide?
The InChIKey is DQIAKDRRXBZBNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O3S/c1-4-20(5-2)13(3)12-18-17(21)14-6-10-16(11-7-14)24(22,23)19-15-8-9-15/h6-7,10-11,13,15,19H,4-5,8-9,12H2,1-3H3,(H,18,21).
What are the key properties of 4-(cyclopropylsulfamoyl)-N-[2-(diethylamino)propyl]benzamide?
4-(cyclopropylsulfamoyl)-N-[2-(diethylamino)propyl]benzamide has a molecular weight of 353.49 g/mol, XLogP of 1.59, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylsulfamoyl)-N-[2-(diethylamino)propyl]benzamide is sourced from PubChem (CID 46433043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).