N-cyclopropyl-2-[(2,5-dimethoxyphenyl)sulfonylamino]benzamide

C18H20N2O5S — CID 7938855

IUPACN-cyclopropyl-2-[(2,5-dimethoxyphenyl)sulfonylamino]benzamide
SMILESCOc1ccc(OC)c(S(=O)(=O)Nc2ccccc2C(=O)NC2CC2)c1
InChIInChI=1S/C18H20N2O5S/c1-24-13-9-10-16(25-2)17(11-13)26(22,23)20-15-6-4-3-5-14(15)18(21)19-12-7-8-12/h3-6,9-12,20H,7-8H2,1-2H3,(H,19,21)
InChIKeyNYTUHPLPLDSCKB-UHFFFAOYSA-N
MW376.43 g/mol
LogP2.40
Rot. Bonds7

About N-cyclopropyl-2-[(2,5-dimethoxyphenyl)sulfonylamino]benzamide

N-cyclopropyl-2-[(2,5-dimethoxyphenyl)sulfonylamino]benzamide (PubChem CID 7938855) has the molecular formula C18H20N2O5S and a molecular weight of 376.43 g/mol. Its IUPAC name is N-cyclopropyl-2-[(2,5-dimethoxyphenyl)sulfonylamino]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[(2,5-dimethoxyphenyl)sulfonylamino]benzamide
PubChem CID7938855
Molecular FormulaC18H20N2O5S
Molecular Weight376.43 g/mol
Exact Mass376.11
IUPAC NameN-cyclopropyl-2-[(2,5-dimethoxyphenyl)sulfonylamino]benzamide
SMILESCOc1ccc(OC)c(S(=O)(=O)Nc2ccccc2C(=O)NC2CC2)c1
InChIInChI=1S/C18H20N2O5S/c1-24-13-9-10-16(25-2)17(11-13)26(22,23)20-15-6-4-3-5-14(15)18(21)19-12-7-8-12/h3-6,9-12,20H,7-8H2,1-2H3,(H,19,21)
InChIKeyNYTUHPLPLDSCKB-UHFFFAOYSA-N
XLogP2.40
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.43
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[(2,5-dimethoxyphenyl)sulfonylamino]benzamide?
The IUPAC name of N-cyclopropyl-2-[(2,5-dimethoxyphenyl)sulfonylamino]benzamide (CID 7938855) is N-cyclopropyl-2-[(2,5-dimethoxyphenyl)sulfonylamino]benzamide.
What is the SMILES notation for N-cyclopropyl-2-[(2,5-dimethoxyphenyl)sulfonylamino]benzamide?
The canonical SMILES for N-cyclopropyl-2-[(2,5-dimethoxyphenyl)sulfonylamino]benzamide is COc1ccc(OC)c(S(=O)(=O)Nc2ccccc2C(=O)NC2CC2)c1.
What is the InChIKey of N-cyclopropyl-2-[(2,5-dimethoxyphenyl)sulfonylamino]benzamide?
The InChIKey is NYTUHPLPLDSCKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O5S/c1-24-13-9-10-16(25-2)17(11-13)26(22,23)20-15-6-4-3-5-14(15)18(21)19-12-7-8-12/h3-6,9-12,20H,7-8H2,1-2H3,(H,19,21).
What are the key properties of N-cyclopropyl-2-[(2,5-dimethoxyphenyl)sulfonylamino]benzamide?
N-cyclopropyl-2-[(2,5-dimethoxyphenyl)sulfonylamino]benzamide has a molecular weight of 376.43 g/mol, XLogP of 2.40, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[(2,5-dimethoxyphenyl)sulfonylamino]benzamide is sourced from PubChem (CID 7938855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).