N-(4-amino-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)acetamide

C17H19N3O2 — CID 16793869

IUPACN-(4-amino-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)acetamide
SMILESCOc1cc(N)ccc1NC(=O)CN1CCc2ccccc21
InChIInChI=1S/C17H19N3O2/c1-22-16-10-13(18)6-7-14(16)19-17(21)11-20-9-8-12-4-2-3-5-15(12)20/h2-7,10H,8-9,11,18H2,1H3,(H,19,21)
InChIKeyMWEWBGZVTUJMFK-UHFFFAOYSA-N
MW297.36 g/mol
LogP2.28
Rot. Bonds4

About N-(4-amino-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)acetamide

N-(4-amino-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)acetamide (PubChem CID 16793869) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is N-(4-amino-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-amino-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)acetamide
PubChem CID16793869
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC NameN-(4-amino-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)acetamide
SMILESCOc1cc(N)ccc1NC(=O)CN1CCc2ccccc21
InChIInChI=1S/C17H19N3O2/c1-22-16-10-13(18)6-7-14(16)19-17(21)11-20-9-8-12-4-2-3-5-15(12)20/h2-7,10H,8-9,11,18H2,1H3,(H,19,21)
InChIKeyMWEWBGZVTUJMFK-UHFFFAOYSA-N
XLogP2.28
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(4-chloro-2,5-dimethoxyphenyl)-2-(2,3-dihydroindol-1-yl)acetamide
CID 22199888
2-(2,3-dihydroindol-1-yl)-N-(2-prop-2-enoxyphenyl)acetamide
CID 54810870
2-(2,3-dihydroindol-1-yl)-N-(2-methylphenyl)acetamide
CID 22199881
N-(4-chloro-2-methylphenyl)-2-(2,3-dihydroindol-1-yl)acetamide
CID 109007270
2-(2,3-dihydroindol-1-yl)-N-(3,5-dimethylphenyl)acetamide
CID 22199883
N-(4-amino-2-methoxyphenyl)-2-(4-hydroxy-4-methylpiperidin-1-yl)acetamide
CID 81098626
2-(2,3-dihydroindol-1-yl)-N-[(3,4-dimethoxyphenyl)methyl]acetamide
CID 8704444
N-(4-amino-2-methoxyphenyl)-2-[4-(hydroxymethyl)piperidin-1-yl]acetamide
CID 43246094
N-(4-amino-2-methoxyphenyl)-2-(3-methylpyrrolidin-1-yl)acetamide
CID 61223798
2-(2,3-dihydroindol-1-yl)-N-(5-fluoro-2-methylphenyl)acetamide
CID 18084883
2-(2,3-dihydroindol-1-yl)-N-phenylacetamide
CID 22199878
N-(4-amino-2-methoxyphenyl)-3-(4-methylpiperazin-1-yl)propanamide
CID 16779280

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)acetamide?
The IUPAC name of N-(4-amino-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)acetamide (CID 16793869) is N-(4-amino-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)acetamide.
What is the SMILES notation for N-(4-amino-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)acetamide?
The canonical SMILES for N-(4-amino-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)acetamide is COc1cc(N)ccc1NC(=O)CN1CCc2ccccc21.
What is the InChIKey of N-(4-amino-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)acetamide?
The InChIKey is MWEWBGZVTUJMFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c1-22-16-10-13(18)6-7-14(16)19-17(21)11-20-9-8-12-4-2-3-5-15(12)20/h2-7,10H,8-9,11,18H2,1H3,(H,19,21).
What are the key properties of N-(4-amino-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)acetamide?
N-(4-amino-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)acetamide has a molecular weight of 297.36 g/mol, XLogP of 2.28, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)acetamide is sourced from PubChem (CID 16793869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).