2-(5-amino-2-oxo-3H-indol-1-yl)-N-(2-methylbutan-2-yl)acetamide

C15H21N3O2 — CID 61486326

IUPAC2-(5-amino-2-oxo-3H-indol-1-yl)-N-(2-methylbutan-2-yl)acetamide
SMILESCCC(C)(C)NC(=O)CN1C(=O)Cc2cc(N)ccc21
InChIInChI=1S/C15H21N3O2/c1-4-15(2,3)17-13(19)9-18-12-6-5-11(16)7-10(12)8-14(18)20/h5-7H,4,8-9,16H2,1-3H3,(H,17,19)
InChIKeyPDRGGDLYPSCVRK-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.46
Rot. Bonds4

About 2-(5-amino-2-oxo-3H-indol-1-yl)-N-(2-methylbutan-2-yl)acetamide

2-(5-amino-2-oxo-3H-indol-1-yl)-N-(2-methylbutan-2-yl)acetamide (PubChem CID 61486326) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 2-(5-amino-2-oxo-3H-indol-1-yl)-N-(2-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-(5-amino-2-oxo-3H-indol-1-yl)-N-(2-methylbutan-2-yl)acetamide
PubChem CID61486326
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name2-(5-amino-2-oxo-3H-indol-1-yl)-N-(2-methylbutan-2-yl)acetamide
SMILESCCC(C)(C)NC(=O)CN1C(=O)Cc2cc(N)ccc21
InChIInChI=1S/C15H21N3O2/c1-4-15(2,3)17-13(19)9-18-12-6-5-11(16)7-10(12)8-14(18)20/h5-7H,4,8-9,16H2,1-3H3,(H,17,19)
InChIKeyPDRGGDLYPSCVRK-UHFFFAOYSA-N
XLogP1.46
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(5-amino-2-oxo-3H-indol-1-yl)-N-(cyanomethyl)acetamide
CID 43382542
5-amino-1-decyl-3H-indol-2-one
CID 62221874
5-amino-1-nonyl-3H-indol-2-one
CID 43446434
4-(5-amino-2-oxo-3H-indol-1-yl)-N-methylbutanamide
CID 63892495
5-amino-1-(3-oxobutyl)-3H-indol-2-one
CID 115235380
2-(7-amino-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)-N-ethylacetamide
CID 43446649
5-amino-1-(4-oxopentyl)-3H-indol-2-one
CID 115236208
5-amino-1-(sulfanylmethyl)-3H-indol-2-one
CID 115227602
5-amino-1-(3,3,3-trifluoropropyl)-3H-indol-2-one
CID 64553558
3-(5-amino-2-oxo-3H-indol-1-yl)-2,2-dimethylpropanenitrile
CID 115233774
2-(6-amino-2-oxo-3,4-dihydroquinolin-1-yl)-N-butan-2-ylacetamide
CID 43446594
2-(7-amino-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)-N-butylacetamide
CID 61485959

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-oxo-3H-indol-1-yl)-N-(2-methylbutan-2-yl)acetamide?
The IUPAC name of 2-(5-amino-2-oxo-3H-indol-1-yl)-N-(2-methylbutan-2-yl)acetamide (CID 61486326) is 2-(5-amino-2-oxo-3H-indol-1-yl)-N-(2-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-(5-amino-2-oxo-3H-indol-1-yl)-N-(2-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-(5-amino-2-oxo-3H-indol-1-yl)-N-(2-methylbutan-2-yl)acetamide is CCC(C)(C)NC(=O)CN1C(=O)Cc2cc(N)ccc21.
What is the InChIKey of 2-(5-amino-2-oxo-3H-indol-1-yl)-N-(2-methylbutan-2-yl)acetamide?
The InChIKey is PDRGGDLYPSCVRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-4-15(2,3)17-13(19)9-18-12-6-5-11(16)7-10(12)8-14(18)20/h5-7H,4,8-9,16H2,1-3H3,(H,17,19).
What are the key properties of 2-(5-amino-2-oxo-3H-indol-1-yl)-N-(2-methylbutan-2-yl)acetamide?
2-(5-amino-2-oxo-3H-indol-1-yl)-N-(2-methylbutan-2-yl)acetamide has a molecular weight of 275.35 g/mol, XLogP of 1.46, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-oxo-3H-indol-1-yl)-N-(2-methylbutan-2-yl)acetamide is sourced from PubChem (CID 61486326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).