N-(4-ethoxy-3-methylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide

C19H19FN2O2 — CID 86877960

IUPACN-(4-ethoxy-3-methylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide
SMILESCCOc1ccc(NC(=O)Cc2c[nH]c3cc(F)ccc23)cc1C
InChIInChI=1S/C19H19FN2O2/c1-3-24-18-7-5-15(8-12(18)2)22-19(23)9-13-11-21-17-10-14(20)4-6-16(13)17/h4-8,10-11,21H,3,9H2,1-2H3,(H,22,23)
InChIKeyISQOJZWAGFONQQ-UHFFFAOYSA-N
MW326.37 g/mol
LogP4.20
Rot. Bonds5

About N-(4-ethoxy-3-methylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide

N-(4-ethoxy-3-methylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide (PubChem CID 86877960) has the molecular formula C19H19FN2O2 and a molecular weight of 326.37 g/mol. Its IUPAC name is N-(4-ethoxy-3-methylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-(4-ethoxy-3-methylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide
PubChem CID86877960
Molecular FormulaC19H19FN2O2
Molecular Weight326.37 g/mol
Exact Mass326.14
IUPAC NameN-(4-ethoxy-3-methylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide
SMILESCCOc1ccc(NC(=O)Cc2c[nH]c3cc(F)ccc23)cc1C
InChIInChI=1S/C19H19FN2O2/c1-3-24-18-7-5-15(8-12(18)2)22-19(23)9-13-11-21-17-10-14(20)4-6-16(13)17/h4-8,10-11,21H,3,9H2,1-2H3,(H,22,23)
InChIKeyISQOJZWAGFONQQ-UHFFFAOYSA-N
XLogP4.20
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.37
LogP ≤ 54.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-bromo-3-methylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide
CID 113209477
methyl 4-[[2-(6-fluoro-1H-indol-3-yl)acetyl]amino]benzoate
CID 113209461
N-(3-acetamidophenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide
CID 110861296
methyl 2-chloro-4-[[2-(6-fluoro-1H-indol-3-yl)acetyl]amino]benzoate
CID 172548040
N-(3-acetylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide
CID 110861017
ethyl (2R)-2-[[2-(6-fluoro-1H-indol-3-yl)acetyl]amino]propanoate
CID 172548012
2-[[2-(6-fluoro-1H-indol-3-yl)acetyl]amino]-2-methylpropanoic acid
CID 119187887
N-[4-(diethylamino)phenyl]-2-(5-fluoro-1H-indol-3-yl)acetamide
CID 113209328
N-(2-ethoxyphenyl)-6-fluoro-1H-indole-3-carboxamide
CID 113206274
6-fluoro-3-[(2-methylphenoxy)methyl]-1H-indole
CID 117178425
N-(3-chloro-4-fluorophenyl)-2-(5-fluoro-1H-indol-3-yl)acetamide
CID 113209314
N-(4-ethoxyphenyl)-2-(6-fluoro-1H-indol-3-yl)-2-oxoacetamide
CID 113208671

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxy-3-methylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide?
The IUPAC name of N-(4-ethoxy-3-methylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide (CID 86877960) is N-(4-ethoxy-3-methylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide.
What is the SMILES notation for N-(4-ethoxy-3-methylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide?
The canonical SMILES for N-(4-ethoxy-3-methylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide is CCOc1ccc(NC(=O)Cc2c[nH]c3cc(F)ccc23)cc1C.
What is the InChIKey of N-(4-ethoxy-3-methylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide?
The InChIKey is ISQOJZWAGFONQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN2O2/c1-3-24-18-7-5-15(8-12(18)2)22-19(23)9-13-11-21-17-10-14(20)4-6-16(13)17/h4-8,10-11,21H,3,9H2,1-2H3,(H,22,23).
What are the key properties of N-(4-ethoxy-3-methylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide?
N-(4-ethoxy-3-methylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide has a molecular weight of 326.37 g/mol, XLogP of 4.20, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxy-3-methylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide is sourced from PubChem (CID 86877960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).