N-[3-[5-[4-(methanesulfonamido)phenyl]-3-pyridinyl]phenyl]acetamide

C20H19N3O3S — CID 155560591

IUPACN-[3-[5-[4-(methanesulfonamido)phenyl]-3-pyridinyl]phenyl]acetamide
SMILESCC(=O)Nc1cccc(-c2cncc(-c3ccc(NS(C)(=O)=O)cc3)c2)c1
InChIInChI=1S/C20H19N3O3S/c1-14(24)22-20-5-3-4-16(11-20)18-10-17(12-21-13-18)15-6-8-19(9-7-15)23-27(2,25)26/h3-13,23H,1-2H3,(H,22,24)
InChIKeyBEUIXJCNKIYAAU-UHFFFAOYSA-N
MW381.46 g/mol
LogP3.75
Rot. Bonds5

About N-[3-[5-[4-(methanesulfonamido)phenyl]-3-pyridinyl]phenyl]acetamide

N-[3-[5-[4-(methanesulfonamido)phenyl]-3-pyridinyl]phenyl]acetamide (PubChem CID 155560591) has the molecular formula C20H19N3O3S and a molecular weight of 381.46 g/mol. Its IUPAC name is N-[3-[5-[4-(methanesulfonamido)phenyl]-3-pyridinyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[5-[4-(methanesulfonamido)phenyl]-3-pyridinyl]phenyl]acetamide
PubChem CID155560591
Molecular FormulaC20H19N3O3S
Molecular Weight381.46 g/mol
Exact Mass381.11
IUPAC NameN-[3-[5-[4-(methanesulfonamido)phenyl]-3-pyridinyl]phenyl]acetamide
SMILESCC(=O)Nc1cccc(-c2cncc(-c3ccc(NS(C)(=O)=O)cc3)c2)c1
InChIInChI=1S/C20H19N3O3S/c1-14(24)22-20-5-3-4-16(11-20)18-10-17(12-21-13-18)15-6-8-19(9-7-15)23-27(2,25)26/h3-13,23H,1-2H3,(H,22,24)
InChIKeyBEUIXJCNKIYAAU-UHFFFAOYSA-N
XLogP3.75
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.46
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(3-acetamidophenyl)benzoate
CID 86306420
N-[3-(methanesulfonamido)phenyl]-3-phenylbenzamide
CID 169152254
3-[3-(methanesulfonamido)phenyl]pyridine-4-carboxylic acid
CID 53224449
5-(3-acetamidophenyl)pyridine-2-carboxylic acid
CID 50998543
N-[3-[3-[5-(methylamino)-3-pyridinyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]acetamide
CID 135258327
1-(3-hydroxyphenyl)-3-[4-(methanesulfonamido)phenyl]urea
CID 108875136
N-(3-acetamidophenyl)-2-chloro-4-(methanesulfonamido)benzamide
CID 28635588
N-[3-(3-aminophenyl)phenyl]acetamide
CID 22724502
5-(3-acetamidophenyl)-N-(diaminomethylidene)naphthalene-2-carboxamide;5-(4-acetamidophenyl)-N-(diaminomethylidene)naphthalene-2-carboxamide;N-(diaminomethylidene)-5-[4-(methanesulfonamido)phenyl]naphthalene-2-carboxamide
CID 161417442
N-[4-[3-[(1S)-1-aminoethyl]phenyl]phenyl]methanesulfonamide
CID 59506232
3-[6-(3-acetamidophenyl)pyrazin-2-yl]benzoic acid
CID 126473086
N-[3-(1H-indazol-5-yl)phenyl]acetamide
CID 56712448

Frequently Asked Questions

What is the IUPAC name of N-[3-[5-[4-(methanesulfonamido)phenyl]-3-pyridinyl]phenyl]acetamide?
The IUPAC name of N-[3-[5-[4-(methanesulfonamido)phenyl]-3-pyridinyl]phenyl]acetamide (CID 155560591) is N-[3-[5-[4-(methanesulfonamido)phenyl]-3-pyridinyl]phenyl]acetamide.
What is the SMILES notation for N-[3-[5-[4-(methanesulfonamido)phenyl]-3-pyridinyl]phenyl]acetamide?
The canonical SMILES for N-[3-[5-[4-(methanesulfonamido)phenyl]-3-pyridinyl]phenyl]acetamide is CC(=O)Nc1cccc(-c2cncc(-c3ccc(NS(C)(=O)=O)cc3)c2)c1.
What is the InChIKey of N-[3-[5-[4-(methanesulfonamido)phenyl]-3-pyridinyl]phenyl]acetamide?
The InChIKey is BEUIXJCNKIYAAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3S/c1-14(24)22-20-5-3-4-16(11-20)18-10-17(12-21-13-18)15-6-8-19(9-7-15)23-27(2,25)26/h3-13,23H,1-2H3,(H,22,24).
What are the key properties of N-[3-[5-[4-(methanesulfonamido)phenyl]-3-pyridinyl]phenyl]acetamide?
N-[3-[5-[4-(methanesulfonamido)phenyl]-3-pyridinyl]phenyl]acetamide has a molecular weight of 381.46 g/mol, XLogP of 3.75, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[5-[4-(methanesulfonamido)phenyl]-3-pyridinyl]phenyl]acetamide is sourced from PubChem (CID 155560591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).