3-(3,4-dichlorophenyl)sulfonyl-N-(6-methoxy-3-pyridinyl)propanamide

C15H14Cl2N2O4S — CID 110620787

IUPAC3-(3,4-dichlorophenyl)sulfonyl-N-(6-methoxy-3-pyridinyl)propanamide
SMILESCOc1ccc(NC(=O)CCS(=O)(=O)c2ccc(Cl)c(Cl)c2)cn1
InChIInChI=1S/C15H14Cl2N2O4S/c1-23-15-5-2-10(9-18-15)19-14(20)6-7-24(21,22)11-3-4-12(16)13(17)8-11/h2-5,8-9H,6-7H2,1H3,(H,19,20)
InChIKeyAOEJDQWTBRBKRF-UHFFFAOYSA-N
MW389.26 g/mol
LogP3.20
Rot. Bonds6

About 3-(3,4-dichlorophenyl)sulfonyl-N-(6-methoxy-3-pyridinyl)propanamide

3-(3,4-dichlorophenyl)sulfonyl-N-(6-methoxy-3-pyridinyl)propanamide (PubChem CID 110620787) has the molecular formula C15H14Cl2N2O4S and a molecular weight of 389.26 g/mol. Its IUPAC name is 3-(3,4-dichlorophenyl)sulfonyl-N-(6-methoxy-3-pyridinyl)propanamide.

Molecular Properties

Compound Name3-(3,4-dichlorophenyl)sulfonyl-N-(6-methoxy-3-pyridinyl)propanamide
PubChem CID110620787
Molecular FormulaC15H14Cl2N2O4S
Molecular Weight389.26 g/mol
Exact Mass388.01
IUPAC Name3-(3,4-dichlorophenyl)sulfonyl-N-(6-methoxy-3-pyridinyl)propanamide
SMILESCOc1ccc(NC(=O)CCS(=O)(=O)c2ccc(Cl)c(Cl)c2)cn1
InChIInChI=1S/C15H14Cl2N2O4S/c1-23-15-5-2-10(9-18-15)19-14(20)6-7-24(21,22)11-3-4-12(16)13(17)8-11/h2-5,8-9H,6-7H2,1H3,(H,19,20)
InChIKeyAOEJDQWTBRBKRF-UHFFFAOYSA-N
XLogP3.20
TPSA85.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.26
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(3-chlorophenyl)sulfonyl-N-(6-methoxy-3-pyridinyl)propanamide
CID 110620805
3-(3,4-dichlorophenyl)sulfonyl-N-pyrimidin-2-ylpropanamide
CID 110673977
N-(4-acetylphenyl)-3-(3-chloro-4-methoxyphenyl)sulfonylpropanamide
CID 110423650
2-chloro-N-(6-methoxy-3-pyridinyl)acetamide
CID 2561820
N-(6-methoxy-3-pyridinyl)-3-[(4-methylphenyl)sulfonylamino]propanamide
CID 8892342
3-(3-chloro-4-methoxyphenyl)sulfonyl-N-(4-cyanophenyl)propanamide
CID 110428569
3-(4-chlorophenyl)sulfonyl-N-(3,4-dimethoxyphenyl)propanamide
CID 46797612
2-chloro-N-[3-[(6-methoxy-3-pyridinyl)amino]-3-oxopropyl]benzamide
CID 40599620
3-acetamido-N-(6-methoxy-3-pyridinyl)propanamide
CID 47096905
N-[4-chloro-3-(trifluoromethyl)phenyl]-3-(4-methoxyphenyl)sulfonylpropanamide
CID 4301032
N-(6-methoxy-3-pyridinyl)-4-phenylbutanamide
CID 52615794
N-(4-acetamidophenyl)-3-(3-chlorophenyl)sulfonylpropanamide
CID 110423914

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dichlorophenyl)sulfonyl-N-(6-methoxy-3-pyridinyl)propanamide?
The IUPAC name of 3-(3,4-dichlorophenyl)sulfonyl-N-(6-methoxy-3-pyridinyl)propanamide (CID 110620787) is 3-(3,4-dichlorophenyl)sulfonyl-N-(6-methoxy-3-pyridinyl)propanamide.
What is the SMILES notation for 3-(3,4-dichlorophenyl)sulfonyl-N-(6-methoxy-3-pyridinyl)propanamide?
The canonical SMILES for 3-(3,4-dichlorophenyl)sulfonyl-N-(6-methoxy-3-pyridinyl)propanamide is COc1ccc(NC(=O)CCS(=O)(=O)c2ccc(Cl)c(Cl)c2)cn1.
What is the InChIKey of 3-(3,4-dichlorophenyl)sulfonyl-N-(6-methoxy-3-pyridinyl)propanamide?
The InChIKey is AOEJDQWTBRBKRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2N2O4S/c1-23-15-5-2-10(9-18-15)19-14(20)6-7-24(21,22)11-3-4-12(16)13(17)8-11/h2-5,8-9H,6-7H2,1H3,(H,19,20).
What are the key properties of 3-(3,4-dichlorophenyl)sulfonyl-N-(6-methoxy-3-pyridinyl)propanamide?
3-(3,4-dichlorophenyl)sulfonyl-N-(6-methoxy-3-pyridinyl)propanamide has a molecular weight of 389.26 g/mol, XLogP of 3.20, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dichlorophenyl)sulfonyl-N-(6-methoxy-3-pyridinyl)propanamide is sourced from PubChem (CID 110620787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).