N-(5-chloro-2-methoxyphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide

C20H17ClN4O3 — CID 53032212

IUPACN-(5-chloro-2-methoxyphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide
SMILESCOc1ccc(Cl)cc1NC(=O)Cn1ccc2ccc(-c3nnc(C)o3)cc21
InChIInChI=1S/C20H17ClN4O3/c1-12-23-24-20(28-12)14-4-3-13-7-8-25(17(13)9-14)11-19(26)22-16-10-15(21)5-6-18(16)27-2/h3-10H,11H2,1-2H3,(H,22,26)
InChIKeyVNKZVNJDEWOVAY-UHFFFAOYSA-N
MW396.83 g/mol
LogP4.30
Rot. Bonds5

About N-(5-chloro-2-methoxyphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide

N-(5-chloro-2-methoxyphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide (PubChem CID 53032212) has the molecular formula C20H17ClN4O3 and a molecular weight of 396.83 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide
PubChem CID53032212
Molecular FormulaC20H17ClN4O3
Molecular Weight396.83 g/mol
Exact Mass396.10
IUPAC NameN-(5-chloro-2-methoxyphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide
SMILESCOc1ccc(Cl)cc1NC(=O)Cn1ccc2ccc(-c3nnc(C)o3)cc21
InChIInChI=1S/C20H17ClN4O3/c1-12-23-24-20(28-12)14-4-3-13-7-8-25(17(13)9-14)11-19(26)22-16-10-15(21)5-6-18(16)27-2/h3-10H,11H2,1-2H3,(H,22,26)
InChIKeyVNKZVNJDEWOVAY-UHFFFAOYSA-N
XLogP4.30
TPSA82.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.83
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3-chlorophenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide
CID 53032158
2-(1,3-dihydroisoindol-2-yl)-N-[2-methoxy-5-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]acetamide
CID 131912300
1-[4-(4-chlorophenyl)piperazin-1-yl]-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]ethanone
CID 53013371
N-[(4-fluorophenyl)methyl]-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide
CID 53032202
2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]-N-(pyridin-3-ylmethyl)acetamide
CID 53032149
3-(methanesulfonamido)-N-[2-methoxy-5-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]propanamide
CID 131925703
N-(5-chloro-2-methoxyphenyl)-2-[2-(4-methylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]acetamide
CID 16956891
N-(5-chloro-2-methoxyphenyl)-2-[2-(5-ethyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide
CID 16835956
N-(5-chloro-2-methoxyphenyl)-2-(6-fluoro-4-oxoquinolin-1-yl)acetamide
CID 100743429
N-(5-chloro-2,4-dimethoxyphenyl)-2-[3-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide
CID 20933469
N-[2-methoxy-5-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]formamide
CID 168650811
N-(5-chloro-2-methoxyphenyl)-2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
CID 17301751

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide (CID 53032212) is N-(5-chloro-2-methoxyphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide is COc1ccc(Cl)cc1NC(=O)Cn1ccc2ccc(-c3nnc(C)o3)cc21.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide?
The InChIKey is VNKZVNJDEWOVAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN4O3/c1-12-23-24-20(28-12)14-4-3-13-7-8-25(17(13)9-14)11-19(26)22-16-10-15(21)5-6-18(16)27-2/h3-10H,11H2,1-2H3,(H,22,26).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide?
N-(5-chloro-2-methoxyphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide has a molecular weight of 396.83 g/mol, XLogP of 4.30, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide is sourced from PubChem (CID 53032212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).