N-(2,5-dichlorophenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide

C17H18Cl2N2O5S — CID 3958242

IUPACN-(2,5-dichlorophenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide
SMILESCOc1ccc(S(=O)(=O)NC(C)C(=O)Nc2cc(Cl)ccc2Cl)cc1OC
InChIInChI=1S/C17H18Cl2N2O5S/c1-10(17(22)20-14-8-11(18)4-6-13(14)19)21-27(23,24)12-5-7-15(25-2)16(9-12)26-3/h4-10,21H,1-3H3,(H,20,22)
InChIKeyCGLJVVGJALXFBN-UHFFFAOYSA-N
MW433.31 g/mol
LogP3.32
Rot. Bonds7

About N-(2,5-dichlorophenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide

N-(2,5-dichlorophenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide (PubChem CID 3958242) has the molecular formula C17H18Cl2N2O5S and a molecular weight of 433.31 g/mol. Its IUPAC name is N-(2,5-dichlorophenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide.

Molecular Properties

Compound NameN-(2,5-dichlorophenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide
PubChem CID3958242
Molecular FormulaC17H18Cl2N2O5S
Molecular Weight433.31 g/mol
Exact Mass432.03
IUPAC NameN-(2,5-dichlorophenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide
SMILESCOc1ccc(S(=O)(=O)NC(C)C(=O)Nc2cc(Cl)ccc2Cl)cc1OC
InChIInChI=1S/C17H18Cl2N2O5S/c1-10(17(22)20-14-8-11(18)4-6-13(14)19)21-27(23,24)12-5-7-15(25-2)16(9-12)26-3/h4-10,21H,1-3H3,(H,20,22)
InChIKeyCGLJVVGJALXFBN-UHFFFAOYSA-N
XLogP3.32
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.31
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-N-(3,5-dichlorophenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide
CID 41302643
(2R)-N-(2,5-dichlorophenyl)-2-[(2-methoxy-5-methylphenyl)sulfonylamino]propanamide
CID 124548996
(2S)-N-(2,5-dichlorophenyl)-2-[(4-methylphenyl)sulfonylamino]propanamide
CID 41329496
(2R)-2-[(4-bromophenyl)sulfonylamino]-N-(5-chloro-2-methoxyphenyl)propanamide
CID 1254747
2-[(3-chloro-4-methoxyphenyl)sulfonylamino]-N-(2-chlorophenyl)propanamide
CID 3885405
(2R)-N-(2,5-dimethoxyphenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide
CID 41339684
(2R)-N-(2,4-dimethoxyphenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide
CID 41339682
(2R)-2-[(4-chlorophenyl)sulfonylamino]-N-(2,5-dimethoxyphenyl)propanamide
CID 7318747
2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(4-methylphenyl)propanamide
CID 5253893
(2R)-N-[3,5-bis(trifluoromethyl)phenyl]-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide
CID 28549200
(2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2-methoxy-5-methylphenyl)propanamide
CID 126398525
(2R)-N-(3-chloro-4-methoxyphenyl)-2-[(2,5-dichlorophenyl)sulfonylamino]propanamide
CID 126396716

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dichlorophenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide?
The IUPAC name of N-(2,5-dichlorophenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide (CID 3958242) is N-(2,5-dichlorophenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide.
What is the SMILES notation for N-(2,5-dichlorophenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide?
The canonical SMILES for N-(2,5-dichlorophenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide is COc1ccc(S(=O)(=O)NC(C)C(=O)Nc2cc(Cl)ccc2Cl)cc1OC.
What is the InChIKey of N-(2,5-dichlorophenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide?
The InChIKey is CGLJVVGJALXFBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18Cl2N2O5S/c1-10(17(22)20-14-8-11(18)4-6-13(14)19)21-27(23,24)12-5-7-15(25-2)16(9-12)26-3/h4-10,21H,1-3H3,(H,20,22).
What are the key properties of N-(2,5-dichlorophenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide?
N-(2,5-dichlorophenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide has a molecular weight of 433.31 g/mol, XLogP of 3.32, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dichlorophenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide is sourced from PubChem (CID 3958242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).