N-[2-(dimethylamino)ethyl]-2-oxo-2-(2-oxo-1,3-dihydroindol-3-yl)acetamide

C14H17N3O3 — CID 4133879

IUPACN-[2-(dimethylamino)ethyl]-2-oxo-2-(2-oxo-1,3-dihydroindol-3-yl)acetamide
SMILESCN(C)CCNC(=O)C(=O)C1C(=O)Nc2ccccc21
InChIInChI=1S/C14H17N3O3/c1-17(2)8-7-15-14(20)12(18)11-9-5-3-4-6-10(9)16-13(11)19/h3-6,11H,7-8H2,1-2H3,(H,15,20)(H,16,19)
InChIKeyGVLOMSTVAFIYFX-UHFFFAOYSA-N
MW275.31 g/mol
LogP-0.03
Rot. Bonds5

About N-[2-(dimethylamino)ethyl]-2-oxo-2-(2-oxo-1,3-dihydroindol-3-yl)acetamide

N-[2-(dimethylamino)ethyl]-2-oxo-2-(2-oxo-1,3-dihydroindol-3-yl)acetamide (PubChem CID 4133879) has the molecular formula C14H17N3O3 and a molecular weight of 275.31 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-2-oxo-2-(2-oxo-1,3-dihydroindol-3-yl)acetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-2-oxo-2-(2-oxo-1,3-dihydroindol-3-yl)acetamide
PubChem CID4133879
Molecular FormulaC14H17N3O3
Molecular Weight275.31 g/mol
Exact Mass275.13
IUPAC NameN-[2-(dimethylamino)ethyl]-2-oxo-2-(2-oxo-1,3-dihydroindol-3-yl)acetamide
SMILESCN(C)CCNC(=O)C(=O)C1C(=O)Nc2ccccc21
InChIInChI=1S/C14H17N3O3/c1-17(2)8-7-15-14(20)12(18)11-9-5-3-4-6-10(9)16-13(11)19/h3-6,11H,7-8H2,1-2H3,(H,15,20)(H,16,19)
InChIKeyGVLOMSTVAFIYFX-UHFFFAOYSA-N
XLogP-0.03
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-2-oxo-2-(2-oxo-1,3-dihydroindol-3-yl)acetamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-2-oxo-2-(2-oxo-1,3-dihydroindol-3-yl)acetamide (CID 4133879) is N-[2-(dimethylamino)ethyl]-2-oxo-2-(2-oxo-1,3-dihydroindol-3-yl)acetamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-2-oxo-2-(2-oxo-1,3-dihydroindol-3-yl)acetamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-2-oxo-2-(2-oxo-1,3-dihydroindol-3-yl)acetamide is CN(C)CCNC(=O)C(=O)C1C(=O)Nc2ccccc21.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-2-oxo-2-(2-oxo-1,3-dihydroindol-3-yl)acetamide?
The InChIKey is GVLOMSTVAFIYFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3/c1-17(2)8-7-15-14(20)12(18)11-9-5-3-4-6-10(9)16-13(11)19/h3-6,11H,7-8H2,1-2H3,(H,15,20)(H,16,19).
What are the key properties of N-[2-(dimethylamino)ethyl]-2-oxo-2-(2-oxo-1,3-dihydroindol-3-yl)acetamide?
N-[2-(dimethylamino)ethyl]-2-oxo-2-(2-oxo-1,3-dihydroindol-3-yl)acetamide has a molecular weight of 275.31 g/mol, XLogP of -0.03, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-2-oxo-2-(2-oxo-1,3-dihydroindol-3-yl)acetamide is sourced from PubChem (CID 4133879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).