4-(cyclopropylsulfamoyl)-N-(3-methyl-2-pyridinyl)benzamide

C16H17N3O3S — CID 27544592

IUPAC4-(cyclopropylsulfamoyl)-N-(3-methyl-2-pyridinyl)benzamide
SMILESCc1cccnc1NC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C16H17N3O3S/c1-11-3-2-10-17-15(11)18-16(20)12-4-8-14(9-5-12)23(21,22)19-13-6-7-13/h2-5,8-10,13,19H,6-7H2,1H3,(H,17,18,20)
InChIKeyDMDQTOKFEFJRTC-UHFFFAOYSA-N
MW331.40 g/mol
LogP2.08
Rot. Bonds5

About 4-(cyclopropylsulfamoyl)-N-(3-methyl-2-pyridinyl)benzamide

4-(cyclopropylsulfamoyl)-N-(3-methyl-2-pyridinyl)benzamide (PubChem CID 27544592) has the molecular formula C16H17N3O3S and a molecular weight of 331.40 g/mol. Its IUPAC name is 4-(cyclopropylsulfamoyl)-N-(3-methyl-2-pyridinyl)benzamide.

Molecular Properties

Compound Name4-(cyclopropylsulfamoyl)-N-(3-methyl-2-pyridinyl)benzamide
PubChem CID27544592
Molecular FormulaC16H17N3O3S
Molecular Weight331.40 g/mol
Exact Mass331.10
IUPAC Name4-(cyclopropylsulfamoyl)-N-(3-methyl-2-pyridinyl)benzamide
SMILESCc1cccnc1NC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C16H17N3O3S/c1-11-3-2-10-17-15(11)18-16(20)12-4-8-14(9-5-12)23(21,22)19-13-6-7-13/h2-5,8-10,13,19H,6-7H2,1H3,(H,17,18,20)
InChIKeyDMDQTOKFEFJRTC-UHFFFAOYSA-N
XLogP2.08
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.40
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(cyclopentylsulfamoyl)-4-methoxy-N-(3-methyl-2-pyridinyl)benzamide
CID 35031433
4-(cyclopropylsulfamoyl)-N-(2-ethyl-6-methylphenyl)benzamide
CID 109058401
4-(cyclopropylsulfamoyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide
CID 109058403
2-methoxy-N-(3-methyl-2-pyridinyl)-5-(oxolan-3-ylsulfamoyl)benzamide
CID 146559541
N-(4-acetamidophenyl)-4-(cyclopropylsulfamoyl)benzamide
CID 30683390
4-(methylamino)-N-(3-methyl-2-pyridinyl)benzamide
CID 55042397
4-(cyclopropylsulfamoyl)-N-[[2-(dimethylamino)-3-pyridinyl]methyl]benzamide
CID 55692896
4-(cyclopropylsulfamoyl)-N-(2-methylsulfanylphenyl)benzamide
CID 46533931
4-(cyclopentylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 44754126
N-(4-acetamido-3-methylphenyl)-4-(cyclopropylsulfamoyl)benzamide
CID 46550501
4-(cyclopropylsulfamoyl)-N-[3-(2-methylpyrimidin-4-yl)phenyl]benzamide
CID 39028264
4-chloro-3-(cyclopropylsulfamoyl)-N-(3-hydroxy-2-pyridinyl)benzamide
CID 18109619

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropylsulfamoyl)-N-(3-methyl-2-pyridinyl)benzamide?
The IUPAC name of 4-(cyclopropylsulfamoyl)-N-(3-methyl-2-pyridinyl)benzamide (CID 27544592) is 4-(cyclopropylsulfamoyl)-N-(3-methyl-2-pyridinyl)benzamide.
What is the SMILES notation for 4-(cyclopropylsulfamoyl)-N-(3-methyl-2-pyridinyl)benzamide?
The canonical SMILES for 4-(cyclopropylsulfamoyl)-N-(3-methyl-2-pyridinyl)benzamide is Cc1cccnc1NC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1.
What is the InChIKey of 4-(cyclopropylsulfamoyl)-N-(3-methyl-2-pyridinyl)benzamide?
The InChIKey is DMDQTOKFEFJRTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O3S/c1-11-3-2-10-17-15(11)18-16(20)12-4-8-14(9-5-12)23(21,22)19-13-6-7-13/h2-5,8-10,13,19H,6-7H2,1H3,(H,17,18,20).
What are the key properties of 4-(cyclopropylsulfamoyl)-N-(3-methyl-2-pyridinyl)benzamide?
4-(cyclopropylsulfamoyl)-N-(3-methyl-2-pyridinyl)benzamide has a molecular weight of 331.40 g/mol, XLogP of 2.08, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylsulfamoyl)-N-(3-methyl-2-pyridinyl)benzamide is sourced from PubChem (CID 27544592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).