N-(4-acetylphenyl)-2-(5-methyl-1H-indol-3-yl)acetamide

C19H18N2O2 — CID 110861147

IUPACN-(4-acetylphenyl)-2-(5-methyl-1H-indol-3-yl)acetamide
SMILESCC(=O)c1ccc(NC(=O)Cc2c[nH]c3ccc(C)cc23)cc1
InChIInChI=1S/C19H18N2O2/c1-12-3-8-18-17(9-12)15(11-20-18)10-19(23)21-16-6-4-14(5-7-16)13(2)22/h3-9,11,20H,10H2,1-2H3,(H,21,23)
InChIKeyBOLLBRIVRRPNED-UHFFFAOYSA-N
MW306.37 g/mol
LogP3.86
Rot. Bonds4

About N-(4-acetylphenyl)-2-(5-methyl-1H-indol-3-yl)acetamide

N-(4-acetylphenyl)-2-(5-methyl-1H-indol-3-yl)acetamide (PubChem CID 110861147) has the molecular formula C19H18N2O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is N-(4-acetylphenyl)-2-(5-methyl-1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-2-(5-methyl-1H-indol-3-yl)acetamide
PubChem CID110861147
Molecular FormulaC19H18N2O2
Molecular Weight306.37 g/mol
Exact Mass306.14
IUPAC NameN-(4-acetylphenyl)-2-(5-methyl-1H-indol-3-yl)acetamide
SMILESCC(=O)c1ccc(NC(=O)Cc2c[nH]c3ccc(C)cc23)cc1
InChIInChI=1S/C19H18N2O2/c1-12-3-8-18-17(9-12)15(11-20-18)10-19(23)21-16-6-4-14(5-7-16)13(2)22/h3-9,11,20H,10H2,1-2H3,(H,21,23)
InChIKeyBOLLBRIVRRPNED-UHFFFAOYSA-N
XLogP3.86
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(4-acetylanilino)-2-oxoethyl]-2-(1H-indol-3-yl)acetamide
CID 112999594
2-[[2-(5-methyl-1H-indol-3-yl)acetyl]amino]acetic acid
CID 110835976
N-(4-bromophenyl)-2-(5-methoxy-1H-indol-3-yl)acetamide
CID 113209668
2-(5-carbamimidoyl-1H-indol-3-yl)-N-(4-phenylphenyl)acetamide
CID 18800618
N-[4-(diethylamino)phenyl]-2-(5-fluoro-1H-indol-3-yl)acetamide
CID 113209328
N-(4-bromophenyl)-2-(1H-indol-3-yl)acetamide
CID 2093840
2-(2,4-dimethylphenyl)-N-(4-methylphenyl)acetamide
CID 7596977
N-(4-acetylphenyl)-2-(2-methylphenyl)acetamide
CID 24696355
N'-(4-acetamidophenyl)-N-(4-acetylphenyl)propanediamide
CID 108956176
2-chloro-N-[2-(5-methyl-1H-indol-3-yl)ethyl]acetamide
CID 17339304
methyl 4-[[2-(6-fluoro-1H-indol-3-yl)acetyl]amino]benzoate
CID 113209461
N-(3-acetylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide
CID 110861017

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-2-(5-methyl-1H-indol-3-yl)acetamide?
The IUPAC name of N-(4-acetylphenyl)-2-(5-methyl-1H-indol-3-yl)acetamide (CID 110861147) is N-(4-acetylphenyl)-2-(5-methyl-1H-indol-3-yl)acetamide.
What is the SMILES notation for N-(4-acetylphenyl)-2-(5-methyl-1H-indol-3-yl)acetamide?
The canonical SMILES for N-(4-acetylphenyl)-2-(5-methyl-1H-indol-3-yl)acetamide is CC(=O)c1ccc(NC(=O)Cc2c[nH]c3ccc(C)cc23)cc1.
What is the InChIKey of N-(4-acetylphenyl)-2-(5-methyl-1H-indol-3-yl)acetamide?
The InChIKey is BOLLBRIVRRPNED-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2/c1-12-3-8-18-17(9-12)15(11-20-18)10-19(23)21-16-6-4-14(5-7-16)13(2)22/h3-9,11,20H,10H2,1-2H3,(H,21,23).
What are the key properties of N-(4-acetylphenyl)-2-(5-methyl-1H-indol-3-yl)acetamide?
N-(4-acetylphenyl)-2-(5-methyl-1H-indol-3-yl)acetamide has a molecular weight of 306.37 g/mol, XLogP of 3.86, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-2-(5-methyl-1H-indol-3-yl)acetamide is sourced from PubChem (CID 110861147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).