N-(2-oxo-1-propyl-3H-indol-3-yl)acetamide

C13H16N2O2 — CID 4236752

IUPACN-(2-oxo-1-propyl-3H-indol-3-yl)acetamide
SMILESCCCN1C(=O)C(NC(C)=O)c2ccccc21
InChIInChI=1S/C13H16N2O2/c1-3-8-15-11-7-5-4-6-10(11)12(13(15)17)14-9(2)16/h4-7,12H,3,8H2,1-2H3,(H,14,16)
InChIKeyKQQZSYBNSQPKFA-UHFFFAOYSA-N
MW232.28 g/mol
LogP1.62
Rot. Bonds3

About N-(2-oxo-1-propyl-3H-indol-3-yl)acetamide

N-(2-oxo-1-propyl-3H-indol-3-yl)acetamide (PubChem CID 4236752) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is N-(2-oxo-1-propyl-3H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-(2-oxo-1-propyl-3H-indol-3-yl)acetamide
PubChem CID4236752
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC NameN-(2-oxo-1-propyl-3H-indol-3-yl)acetamide
SMILESCCCN1C(=O)C(NC(C)=O)c2ccccc21
InChIInChI=1S/C13H16N2O2/c1-3-8-15-11-7-5-4-6-10(11)12(13(15)17)14-9(2)16/h4-7,12H,3,8H2,1-2H3,(H,14,16)
InChIKeyKQQZSYBNSQPKFA-UHFFFAOYSA-N
XLogP1.62
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-1-propyl-3H-indol-3-yl)acetamide?
The IUPAC name of N-(2-oxo-1-propyl-3H-indol-3-yl)acetamide (CID 4236752) is N-(2-oxo-1-propyl-3H-indol-3-yl)acetamide.
What is the SMILES notation for N-(2-oxo-1-propyl-3H-indol-3-yl)acetamide?
The canonical SMILES for N-(2-oxo-1-propyl-3H-indol-3-yl)acetamide is CCCN1C(=O)C(NC(C)=O)c2ccccc21.
What is the InChIKey of N-(2-oxo-1-propyl-3H-indol-3-yl)acetamide?
The InChIKey is KQQZSYBNSQPKFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-3-8-15-11-7-5-4-6-10(11)12(13(15)17)14-9(2)16/h4-7,12H,3,8H2,1-2H3,(H,14,16).
What are the key properties of N-(2-oxo-1-propyl-3H-indol-3-yl)acetamide?
N-(2-oxo-1-propyl-3H-indol-3-yl)acetamide has a molecular weight of 232.28 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-1-propyl-3H-indol-3-yl)acetamide is sourced from PubChem (CID 4236752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).