N-(3-chlorophenyl)-2-[4-(2,3-dihydroindol-1-ylsulfonyl)imidazol-1-yl]acetamide

C19H17ClN4O3S — CID 20949899

IUPACN-(3-chlorophenyl)-2-[4-(2,3-dihydroindol-1-ylsulfonyl)imidazol-1-yl]acetamide
SMILESO=C(Cn1cnc(S(=O)(=O)N2CCc3ccccc32)c1)Nc1cccc(Cl)c1
InChIInChI=1S/C19H17ClN4O3S/c20-15-5-3-6-16(10-15)22-18(25)11-23-12-19(21-13-23)28(26,27)24-9-8-14-4-1-2-7-17(14)24/h1-7,10,12-13H,8-9,11H2,(H,22,25)
InChIKeyASYDBZATBJZXPI-UHFFFAOYSA-N
MW416.89 g/mol
LogP2.93
Rot. Bonds5

About N-(3-chlorophenyl)-2-[4-(2,3-dihydroindol-1-ylsulfonyl)imidazol-1-yl]acetamide

N-(3-chlorophenyl)-2-[4-(2,3-dihydroindol-1-ylsulfonyl)imidazol-1-yl]acetamide (PubChem CID 20949899) has the molecular formula C19H17ClN4O3S and a molecular weight of 416.89 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-[4-(2,3-dihydroindol-1-ylsulfonyl)imidazol-1-yl]acetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-[4-(2,3-dihydroindol-1-ylsulfonyl)imidazol-1-yl]acetamide
PubChem CID20949899
Molecular FormulaC19H17ClN4O3S
Molecular Weight416.89 g/mol
Exact Mass416.07
IUPAC NameN-(3-chlorophenyl)-2-[4-(2,3-dihydroindol-1-ylsulfonyl)imidazol-1-yl]acetamide
SMILESO=C(Cn1cnc(S(=O)(=O)N2CCc3ccccc32)c1)Nc1cccc(Cl)c1
InChIInChI=1S/C19H17ClN4O3S/c20-15-5-3-6-16(10-15)22-18(25)11-23-12-19(21-13-23)28(26,27)24-9-8-14-4-1-2-7-17(14)24/h1-7,10,12-13H,8-9,11H2,(H,22,25)
InChIKeyASYDBZATBJZXPI-UHFFFAOYSA-N
XLogP2.93
TPSA84.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.89
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(4-chlorophenyl)methyl]-2-[4-(2,3-dihydroindol-1-ylsulfonyl)imidazol-1-yl]acetamide
CID 20949902
2-[4-(2,3-dihydroindol-1-ylsulfonyl)imidazol-1-yl]-N-(1,3-thiazol-2-yl)acetamide
CID 20949888
N-(2,4-difluorophenyl)-2-[4-(2,3-dihydroindol-1-ylsulfonyl)imidazol-1-yl]acetamide
CID 20949910
2-[4-(2,3-dihydroindol-1-ylsulfonyl)imidazol-1-yl]-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide
CID 20949960
N-(3-chlorophenyl)-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide
CID 7900124
N-(3-methylphenyl)-2-(4-piperidin-1-ylsulfonylimidazol-1-yl)acetamide
CID 20949569
[(2R)-1-(3-chloroanilino)-1-oxopropan-2-yl] 4-chloro-3-(2,3-dihydroindol-1-ylsulfonyl)benzoate
CID 2410495
N-(4-chlorophenyl)-2-[4-(4-methylpiperidin-1-yl)sulfonylimidazol-1-yl]acetamide
CID 20949616
[2-(3-chloroanilino)-2-oxoethyl] (E)-3-[3-(2,3-dihydroindol-1-ylsulfonyl)-4,5-dimethoxyphenyl]prop-2-enoate
CID 2646231
N-(4-chlorophenyl)-3-(2,3-dihydroindol-1-ylsulfonyl)propanamide
CID 110343101
2-[4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]-N-phenylacetamide
CID 4305979
N-(3-chlorophenyl)-2-(4-formylpiperazin-1-yl)acetamide
CID 108995802

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-[4-(2,3-dihydroindol-1-ylsulfonyl)imidazol-1-yl]acetamide?
The IUPAC name of N-(3-chlorophenyl)-2-[4-(2,3-dihydroindol-1-ylsulfonyl)imidazol-1-yl]acetamide (CID 20949899) is N-(3-chlorophenyl)-2-[4-(2,3-dihydroindol-1-ylsulfonyl)imidazol-1-yl]acetamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-[4-(2,3-dihydroindol-1-ylsulfonyl)imidazol-1-yl]acetamide?
The canonical SMILES for N-(3-chlorophenyl)-2-[4-(2,3-dihydroindol-1-ylsulfonyl)imidazol-1-yl]acetamide is O=C(Cn1cnc(S(=O)(=O)N2CCc3ccccc32)c1)Nc1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-2-[4-(2,3-dihydroindol-1-ylsulfonyl)imidazol-1-yl]acetamide?
The InChIKey is ASYDBZATBJZXPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN4O3S/c20-15-5-3-6-16(10-15)22-18(25)11-23-12-19(21-13-23)28(26,27)24-9-8-14-4-1-2-7-17(14)24/h1-7,10,12-13H,8-9,11H2,(H,22,25).
What are the key properties of N-(3-chlorophenyl)-2-[4-(2,3-dihydroindol-1-ylsulfonyl)imidazol-1-yl]acetamide?
N-(3-chlorophenyl)-2-[4-(2,3-dihydroindol-1-ylsulfonyl)imidazol-1-yl]acetamide has a molecular weight of 416.89 g/mol, XLogP of 2.93, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-[4-(2,3-dihydroindol-1-ylsulfonyl)imidazol-1-yl]acetamide is sourced from PubChem (CID 20949899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).