2-(1-methylindol-3-yl)-N-[(4-methylphenyl)methyl]acetamide

C19H20N2O — CID 4523425

IUPAC2-(1-methylindol-3-yl)-N-[(4-methylphenyl)methyl]acetamide
SMILESCc1ccc(CNC(=O)Cc2cn(C)c3ccccc23)cc1
InChIInChI=1S/C19H20N2O/c1-14-7-9-15(10-8-14)12-20-19(22)11-16-13-21(2)18-6-4-3-5-17(16)18/h3-10,13H,11-12H2,1-2H3,(H,20,22)
InChIKeyXVUJETSWLXSYEN-UHFFFAOYSA-N
MW292.38 g/mol
LogP3.35
Rot. Bonds4

About 2-(1-methylindol-3-yl)-N-[(4-methylphenyl)methyl]acetamide

2-(1-methylindol-3-yl)-N-[(4-methylphenyl)methyl]acetamide (PubChem CID 4523425) has the molecular formula C19H20N2O and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-(1-methylindol-3-yl)-N-[(4-methylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(1-methylindol-3-yl)-N-[(4-methylphenyl)methyl]acetamide
PubChem CID4523425
Molecular FormulaC19H20N2O
Molecular Weight292.38 g/mol
Exact Mass292.16
IUPAC Name2-(1-methylindol-3-yl)-N-[(4-methylphenyl)methyl]acetamide
SMILESCc1ccc(CNC(=O)Cc2cn(C)c3ccccc23)cc1
InChIInChI=1S/C19H20N2O/c1-14-7-9-15(10-8-14)12-20-19(22)11-16-13-21(2)18-6-4-3-5-17(16)18/h3-10,13H,11-12H2,1-2H3,(H,20,22)
InChIKeyXVUJETSWLXSYEN-UHFFFAOYSA-N
XLogP3.35
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(4-fluorophenyl)methyl]-2-(1-methylindol-3-yl)acetamide
CID 3632445
N-(2-aminoethyl)-2-(1-methylindol-3-yl)acetamide
CID 82289252
N-(2-methoxyethyl)-2-(1-methylindol-3-yl)acetamide
CID 3237946
N-(2-aminopropyl)-2-(1-methylindol-3-yl)acetamide
CID 110832860
N-but-3-ynyl-2-(1-methylindol-3-yl)acetamide
CID 90537865
2-(1-methylindol-3-yl)-N-propan-2-ylacetamide
CID 13010552
N-[2-(1-methylindol-3-yl)ethyl]-2-phenylacetamide
CID 45069412
2-(2-fluorophenyl)-N-[(1-methylindol-3-yl)methyl]acetamide
CID 110782275
N-(2-ethylphenyl)-2-(1-methylindol-3-yl)acetamide
CID 4523543
N-[(4-methoxyphenyl)methyl]-1-methylindole-3-carboxamide
CID 9208154
N-[(1-benzylpyrazol-4-yl)methyl]-2-(4-methylphenyl)acetamide
CID 86990135
N-[(1-methylindol-3-yl)methyl]-2-(propan-2-ylamino)acetamide
CID 115158236

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylindol-3-yl)-N-[(4-methylphenyl)methyl]acetamide?
The IUPAC name of 2-(1-methylindol-3-yl)-N-[(4-methylphenyl)methyl]acetamide (CID 4523425) is 2-(1-methylindol-3-yl)-N-[(4-methylphenyl)methyl]acetamide.
What is the SMILES notation for 2-(1-methylindol-3-yl)-N-[(4-methylphenyl)methyl]acetamide?
The canonical SMILES for 2-(1-methylindol-3-yl)-N-[(4-methylphenyl)methyl]acetamide is Cc1ccc(CNC(=O)Cc2cn(C)c3ccccc23)cc1.
What is the InChIKey of 2-(1-methylindol-3-yl)-N-[(4-methylphenyl)methyl]acetamide?
The InChIKey is XVUJETSWLXSYEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O/c1-14-7-9-15(10-8-14)12-20-19(22)11-16-13-21(2)18-6-4-3-5-17(16)18/h3-10,13H,11-12H2,1-2H3,(H,20,22).
What are the key properties of 2-(1-methylindol-3-yl)-N-[(4-methylphenyl)methyl]acetamide?
2-(1-methylindol-3-yl)-N-[(4-methylphenyl)methyl]acetamide has a molecular weight of 292.38 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylindol-3-yl)-N-[(4-methylphenyl)methyl]acetamide is sourced from PubChem (CID 4523425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).