2-(2-chloro-6-fluorophenyl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide

C19H18ClFN2O2 — CID 2989330

IUPAC2-(2-chloro-6-fluorophenyl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide
SMILESCOc1ccc2[nH]cc(CCNC(=O)Cc3c(F)cccc3Cl)c2c1
InChIInChI=1S/C19H18ClFN2O2/c1-25-13-5-6-18-14(9-13)12(11-23-18)7-8-22-19(24)10-15-16(20)3-2-4-17(15)21/h2-6,9,11,23H,7-8,10H2,1H3,(H,22,24)
InChIKeyGXJVFKOKBPIHFM-UHFFFAOYSA-N
MW360.82 g/mol
LogP3.87
Rot. Bonds6

About 2-(2-chloro-6-fluorophenyl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide

2-(2-chloro-6-fluorophenyl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide (PubChem CID 2989330) has the molecular formula C19H18ClFN2O2 and a molecular weight of 360.82 g/mol. Its IUPAC name is 2-(2-chloro-6-fluorophenyl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2-chloro-6-fluorophenyl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide
PubChem CID2989330
Molecular FormulaC19H18ClFN2O2
Molecular Weight360.82 g/mol
Exact Mass360.10
IUPAC Name2-(2-chloro-6-fluorophenyl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide
SMILESCOc1ccc2[nH]cc(CCNC(=O)Cc3c(F)cccc3Cl)c2c1
InChIInChI=1S/C19H18ClFN2O2/c1-25-13-5-6-18-14(9-13)12(11-23-18)7-8-22-19(24)10-15-16(20)3-2-4-17(15)21/h2-6,9,11,23H,7-8,10H2,1H3,(H,22,24)
InChIKeyGXJVFKOKBPIHFM-UHFFFAOYSA-N
XLogP3.87
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.82
LogP ≤ 53.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-6-fluorophenyl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide?
The IUPAC name of 2-(2-chloro-6-fluorophenyl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide (CID 2989330) is 2-(2-chloro-6-fluorophenyl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide.
What is the SMILES notation for 2-(2-chloro-6-fluorophenyl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide?
The canonical SMILES for 2-(2-chloro-6-fluorophenyl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide is COc1ccc2[nH]cc(CCNC(=O)Cc3c(F)cccc3Cl)c2c1.
What is the InChIKey of 2-(2-chloro-6-fluorophenyl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide?
The InChIKey is GXJVFKOKBPIHFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClFN2O2/c1-25-13-5-6-18-14(9-13)12(11-23-18)7-8-22-19(24)10-15-16(20)3-2-4-17(15)21/h2-6,9,11,23H,7-8,10H2,1H3,(H,22,24).
What are the key properties of 2-(2-chloro-6-fluorophenyl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide?
2-(2-chloro-6-fluorophenyl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide has a molecular weight of 360.82 g/mol, XLogP of 3.87, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-6-fluorophenyl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide is sourced from PubChem (CID 2989330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).