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

C19H14ClFN4O2 — CID 53032213

IUPACN-(3-chloro-4-fluorophenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide
SMILESCc1nnc(-c2ccc3ccn(CC(=O)Nc4ccc(F)c(Cl)c4)c3c2)o1
InChIInChI=1S/C19H14ClFN4O2/c1-11-23-24-19(27-11)13-3-2-12-6-7-25(17(12)8-13)10-18(26)22-14-4-5-16(21)15(20)9-14/h2-9H,10H2,1H3,(H,22,26)
InChIKeyWWSDPERHQIWOGC-UHFFFAOYSA-N
MW384.80 g/mol
LogP4.43
Rot. Bonds4

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

N-(3-chloro-4-fluorophenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide (PubChem CID 53032213) has the molecular formula C19H14ClFN4O2 and a molecular weight of 384.80 g/mol. Its IUPAC name is N-(3-chloro-4-fluorophenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide.

Molecular Properties

Compound NameN-(3-chloro-4-fluorophenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide
PubChem CID53032213
Molecular FormulaC19H14ClFN4O2
Molecular Weight384.80 g/mol
Exact Mass384.08
IUPAC NameN-(3-chloro-4-fluorophenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide
SMILESCc1nnc(-c2ccc3ccn(CC(=O)Nc4ccc(F)c(Cl)c4)c3c2)o1
InChIInChI=1S/C19H14ClFN4O2/c1-11-23-24-19(27-11)13-3-2-12-6-7-25(17(12)8-13)10-18(26)22-14-4-5-16(21)15(20)9-14/h2-9H,10H2,1H3,(H,22,26)
InChIKeyWWSDPERHQIWOGC-UHFFFAOYSA-N
XLogP4.43
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.80
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-fluorophenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide?
The IUPAC name of N-(3-chloro-4-fluorophenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide (CID 53032213) is N-(3-chloro-4-fluorophenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide.
What is the SMILES notation for N-(3-chloro-4-fluorophenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide?
The canonical SMILES for N-(3-chloro-4-fluorophenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide is Cc1nnc(-c2ccc3ccn(CC(=O)Nc4ccc(F)c(Cl)c4)c3c2)o1.
What is the InChIKey of N-(3-chloro-4-fluorophenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide?
The InChIKey is WWSDPERHQIWOGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14ClFN4O2/c1-11-23-24-19(27-11)13-3-2-12-6-7-25(17(12)8-13)10-18(26)22-14-4-5-16(21)15(20)9-14/h2-9H,10H2,1H3,(H,22,26).
What are the key properties of N-(3-chloro-4-fluorophenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide?
N-(3-chloro-4-fluorophenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide has a molecular weight of 384.80 g/mol, XLogP of 4.43, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-fluorophenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide is sourced from PubChem (CID 53032213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).