N-(4-methoxyphenyl)sulfonyl-N-[2-[(Z)-2-pyridin-4-ylethenyl]phenyl]acetamide

C22H20N2O4S — CID 167028467

IUPACN-(4-methoxyphenyl)sulfonyl-N-[2-[(Z)-2-pyridin-4-ylethenyl]phenyl]acetamide
SMILESCOc1ccc(S(=O)(=O)N(C(C)=O)c2ccccc2/C=C\c2ccncc2)cc1
InChIInChI=1S/C22H20N2O4S/c1-17(25)24(29(26,27)21-11-9-20(28-2)10-12-21)22-6-4-3-5-19(22)8-7-18-13-15-23-16-14-18/h3-16H,1-2H3/b8-7-
InChIKeyXZWCYESVKLEKQO-FPLPWBNLSA-N
MW408.48 g/mol
LogP4.00
Rot. Bonds6

About N-(4-methoxyphenyl)sulfonyl-N-[2-[(Z)-2-pyridin-4-ylethenyl]phenyl]acetamide

N-(4-methoxyphenyl)sulfonyl-N-[2-[(Z)-2-pyridin-4-ylethenyl]phenyl]acetamide (PubChem CID 167028467) has the molecular formula C22H20N2O4S and a molecular weight of 408.48 g/mol. Its IUPAC name is N-(4-methoxyphenyl)sulfonyl-N-[2-[(Z)-2-pyridin-4-ylethenyl]phenyl]acetamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)sulfonyl-N-[2-[(Z)-2-pyridin-4-ylethenyl]phenyl]acetamide
PubChem CID167028467
Molecular FormulaC22H20N2O4S
Molecular Weight408.48 g/mol
Exact Mass408.11
IUPAC NameN-(4-methoxyphenyl)sulfonyl-N-[2-[(Z)-2-pyridin-4-ylethenyl]phenyl]acetamide
SMILESCOc1ccc(S(=O)(=O)N(C(C)=O)c2ccccc2/C=C\c2ccncc2)cc1
InChIInChI=1S/C22H20N2O4S/c1-17(25)24(29(26,27)21-11-9-20(28-2)10-12-21)22-6-4-3-5-19(22)8-7-18-13-15-23-16-14-18/h3-16H,1-2H3/b8-7-
InChIKeyXZWCYESVKLEKQO-FPLPWBNLSA-N
XLogP4.00
TPSA76.57 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.48
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-methoxyphenyl)sulfonyl-N-[2-[(E)-2-pyridin-4-ylethenyl]phenyl]pyridine-3-carboxamide
CID 142655552
2-[N-(4-methoxyphenyl)sulfonyl-2-[(E)-2-pyridin-4-ylethenyl]anilino]-N,N-dimethylacetamide
CID 139895048
N-(2-hydroxyethyl)-4-methoxy-N-[2-[(E)-2-pyridin-4-ylethenyl]phenyl]benzenesulfonamide
CID 10272987
2-[N-(4-methoxyphenyl)sulfonyl-2-[(Z)-2-pyridin-3-ylethenyl]anilino]acetic acid
CID 139895004
2-[N-(4-methylphenyl)sulfonyl-2-[(E)-2-pyridin-4-ylethenyl]anilino]acetic acid
CID 139894940
N-(4-methoxyphenyl)sulfonyl-2-(4-methylpiperazin-1-yl)-N-[2-[2-(1-oxidopyridin-1-ium-4-yl)ethenyl]phenyl]acetamide
CID 69341477
2-[N-(4-methoxyphenyl)sulfonyl-2-[(Z)-2-(1-oxidopyridin-1-ium-3-yl)ethenyl]anilino]acetic acid
CID 139894948
(E)-N-(benzenesulfonyl)-N,3-bis(4-methoxyphenyl)prop-2-enamide
CID 19211692
tert-butyl 2-[N-(4-methoxyphenyl)sulfonyl-2-[(Z)-2-(1-oxidopyridin-1-ium-3-yl)ethenyl]anilino]acetate
CID 139895016
2-[N-(4-methoxyphenyl)sulfonyl-2-[(Z)-2-(1-oxidopyridin-1-ium-2-yl)ethenyl]anilino]acetic acid
CID 139895022
2-hydroxy-2-[(4-methoxyphenyl)sulfonyl-[[2-[(E)-2-(1-oxidopyridin-1-ium-4-yl)ethenyl]phenyl]methyl]amino]acetamide
CID 139895013
(E)-N-(4-methoxyphenyl)-3-(4-methylphenyl)-N-(4-methylphenyl)sulfonylprop-2-enamide
CID 19212337

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)sulfonyl-N-[2-[(Z)-2-pyridin-4-ylethenyl]phenyl]acetamide?
The IUPAC name of N-(4-methoxyphenyl)sulfonyl-N-[2-[(Z)-2-pyridin-4-ylethenyl]phenyl]acetamide (CID 167028467) is N-(4-methoxyphenyl)sulfonyl-N-[2-[(Z)-2-pyridin-4-ylethenyl]phenyl]acetamide.
What is the SMILES notation for N-(4-methoxyphenyl)sulfonyl-N-[2-[(Z)-2-pyridin-4-ylethenyl]phenyl]acetamide?
The canonical SMILES for N-(4-methoxyphenyl)sulfonyl-N-[2-[(Z)-2-pyridin-4-ylethenyl]phenyl]acetamide is COc1ccc(S(=O)(=O)N(C(C)=O)c2ccccc2/C=C\c2ccncc2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)sulfonyl-N-[2-[(Z)-2-pyridin-4-ylethenyl]phenyl]acetamide?
The InChIKey is XZWCYESVKLEKQO-FPLPWBNLSA-N. The full InChI is InChI=1S/C22H20N2O4S/c1-17(25)24(29(26,27)21-11-9-20(28-2)10-12-21)22-6-4-3-5-19(22)8-7-18-13-15-23-16-14-18/h3-16H,1-2H3/b8-7-.
What are the key properties of N-(4-methoxyphenyl)sulfonyl-N-[2-[(Z)-2-pyridin-4-ylethenyl]phenyl]acetamide?
N-(4-methoxyphenyl)sulfonyl-N-[2-[(Z)-2-pyridin-4-ylethenyl]phenyl]acetamide has a molecular weight of 408.48 g/mol, XLogP of 4.00, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)sulfonyl-N-[2-[(Z)-2-pyridin-4-ylethenyl]phenyl]acetamide is sourced from PubChem (CID 167028467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).