2-[(2-oxochromen-6-yl)sulfonylamino]-N-prop-2-enylbenzamide

C19H16N2O5S — CID 43053206

IUPAC2-[(2-oxochromen-6-yl)sulfonylamino]-N-prop-2-enylbenzamide
SMILESC=CCNC(=O)c1ccccc1NS(=O)(=O)c1ccc2oc(=O)ccc2c1
InChIInChI=1S/C19H16N2O5S/c1-2-11-20-19(23)15-5-3-4-6-16(15)21-27(24,25)14-8-9-17-13(12-14)7-10-18(22)26-17/h2-10,12,21H,1,11H2,(H,20,23)
InChIKeyRBSMDOHQBSCRTQ-UHFFFAOYSA-N
MW384.41 g/mol
LogP2.51
Rot. Bonds6

About 2-[(2-oxochromen-6-yl)sulfonylamino]-N-prop-2-enylbenzamide

2-[(2-oxochromen-6-yl)sulfonylamino]-N-prop-2-enylbenzamide (PubChem CID 43053206) has the molecular formula C19H16N2O5S and a molecular weight of 384.41 g/mol. Its IUPAC name is 2-[(2-oxochromen-6-yl)sulfonylamino]-N-prop-2-enylbenzamide.

Molecular Properties

Compound Name2-[(2-oxochromen-6-yl)sulfonylamino]-N-prop-2-enylbenzamide
PubChem CID43053206
Molecular FormulaC19H16N2O5S
Molecular Weight384.41 g/mol
Exact Mass384.08
IUPAC Name2-[(2-oxochromen-6-yl)sulfonylamino]-N-prop-2-enylbenzamide
SMILESC=CCNC(=O)c1ccccc1NS(=O)(=O)c1ccc2oc(=O)ccc2c1
InChIInChI=1S/C19H16N2O5S/c1-2-11-20-19(23)15-5-3-4-6-16(15)21-27(24,25)14-8-9-17-13(12-14)7-10-18(22)26-17/h2-10,12,21H,1,11H2,(H,20,23)
InChIKeyRBSMDOHQBSCRTQ-UHFFFAOYSA-N
XLogP2.51
TPSA105.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.41
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-[(2-oxochromen-6-yl)sulfonylamino]-N-prop-2-enylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(2-oxochromen-6-yl)sulfonylamino]-N-propylbenzamide
CID 30713734
2-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]-N-prop-2-enylbenzamide
CID 46680428
2-[(2-oxochromen-6-yl)sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide
CID 30713520
2-[(4-phenoxyphenyl)sulfonylamino]-N-prop-2-enylbenzamide
CID 92683033
2-[(3-fluoro-4-methoxyphenyl)sulfonylamino]-N-prop-2-enylbenzamide
CID 39827756
N-prop-2-enyl-2-[[3-(2,2,2-trifluoroethylcarbamoyl)phenyl]sulfonylamino]benzamide
CID 55879588
N-butyl-2-(naphthalen-2-ylsulfonylamino)benzamide
CID 2219434
2-[(2-nitrophenyl)sulfonylamino]-N-prop-2-enylbenzamide
CID 7933003
N-[4-[(2-oxochromen-6-yl)sulfonylamino]phenyl]acetamide
CID 18524688
2-oxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)chromene-6-sulfonamide
CID 55544360
2-[(2-methoxyphenyl)sulfonylamino]-N-prop-2-enylbenzamide
CID 51170213
2-[[3-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]-N-prop-2-enylbenzamide
CID 34743144

Frequently Asked Questions

What is the IUPAC name of 2-[(2-oxochromen-6-yl)sulfonylamino]-N-prop-2-enylbenzamide?
The IUPAC name of 2-[(2-oxochromen-6-yl)sulfonylamino]-N-prop-2-enylbenzamide (CID 43053206) is 2-[(2-oxochromen-6-yl)sulfonylamino]-N-prop-2-enylbenzamide.
What is the SMILES notation for 2-[(2-oxochromen-6-yl)sulfonylamino]-N-prop-2-enylbenzamide?
The canonical SMILES for 2-[(2-oxochromen-6-yl)sulfonylamino]-N-prop-2-enylbenzamide is C=CCNC(=O)c1ccccc1NS(=O)(=O)c1ccc2oc(=O)ccc2c1.
What is the InChIKey of 2-[(2-oxochromen-6-yl)sulfonylamino]-N-prop-2-enylbenzamide?
The InChIKey is RBSMDOHQBSCRTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O5S/c1-2-11-20-19(23)15-5-3-4-6-16(15)21-27(24,25)14-8-9-17-13(12-14)7-10-18(22)26-17/h2-10,12,21H,1,11H2,(H,20,23).
What are the key properties of 2-[(2-oxochromen-6-yl)sulfonylamino]-N-prop-2-enylbenzamide?
2-[(2-oxochromen-6-yl)sulfonylamino]-N-prop-2-enylbenzamide has a molecular weight of 384.41 g/mol, XLogP of 2.51, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-oxochromen-6-yl)sulfonylamino]-N-prop-2-enylbenzamide is sourced from PubChem (CID 43053206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).