N-(3a,4,4-trimethyl-2-oxo-1H-imidazo[1,2-a]indol-3-yl)acetamide

C15H19N3O2 — CID 101398865

IUPACN-(3a,4,4-trimethyl-2-oxo-1H-imidazo[1,2-a]indol-3-yl)acetamide
SMILESCC(=O)NN1C(=O)CN2c3ccccc3C(C)(C)C12C
InChIInChI=1S/C15H19N3O2/c1-10(19)16-18-13(20)9-17-12-8-6-5-7-11(12)14(2,3)15(17,18)4/h5-8H,9H2,1-4H3,(H,16,19)
InChIKeyKZXWDEPXSLEIKS-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.39
Rot. Bonds1

About N-(3a,4,4-trimethyl-2-oxo-1H-imidazo[1,2-a]indol-3-yl)acetamide

N-(3a,4,4-trimethyl-2-oxo-1H-imidazo[1,2-a]indol-3-yl)acetamide (PubChem CID 101398865) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is N-(3a,4,4-trimethyl-2-oxo-1H-imidazo[1,2-a]indol-3-yl)acetamide.

Molecular Properties

Compound NameN-(3a,4,4-trimethyl-2-oxo-1H-imidazo[1,2-a]indol-3-yl)acetamide
PubChem CID101398865
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC NameN-(3a,4,4-trimethyl-2-oxo-1H-imidazo[1,2-a]indol-3-yl)acetamide
SMILESCC(=O)NN1C(=O)CN2c3ccccc3C(C)(C)C12C
InChIInChI=1S/C15H19N3O2/c1-10(19)16-18-13(20)9-17-12-8-6-5-7-11(12)14(2,3)15(17,18)4/h5-8H,9H2,1-4H3,(H,16,19)
InChIKeyKZXWDEPXSLEIKS-UHFFFAOYSA-N
XLogP1.39
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3a,4,4-trimethyl-2-oxo-1H-imidazo[1,2-a]indol-3-yl)acetamide?
The IUPAC name of N-(3a,4,4-trimethyl-2-oxo-1H-imidazo[1,2-a]indol-3-yl)acetamide (CID 101398865) is N-(3a,4,4-trimethyl-2-oxo-1H-imidazo[1,2-a]indol-3-yl)acetamide.
What is the SMILES notation for N-(3a,4,4-trimethyl-2-oxo-1H-imidazo[1,2-a]indol-3-yl)acetamide?
The canonical SMILES for N-(3a,4,4-trimethyl-2-oxo-1H-imidazo[1,2-a]indol-3-yl)acetamide is CC(=O)NN1C(=O)CN2c3ccccc3C(C)(C)C12C.
What is the InChIKey of N-(3a,4,4-trimethyl-2-oxo-1H-imidazo[1,2-a]indol-3-yl)acetamide?
The InChIKey is KZXWDEPXSLEIKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-10(19)16-18-13(20)9-17-12-8-6-5-7-11(12)14(2,3)15(17,18)4/h5-8H,9H2,1-4H3,(H,16,19).
What are the key properties of N-(3a,4,4-trimethyl-2-oxo-1H-imidazo[1,2-a]indol-3-yl)acetamide?
N-(3a,4,4-trimethyl-2-oxo-1H-imidazo[1,2-a]indol-3-yl)acetamide has a molecular weight of 273.34 g/mol, XLogP of 1.39, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3a,4,4-trimethyl-2-oxo-1H-imidazo[1,2-a]indol-3-yl)acetamide is sourced from PubChem (CID 101398865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).