1-cyclopropyl-3,3-dimethyl-2-oxoindole-6-carboxamide

C14H16N2O2 — CID 125482166

IUPAC1-cyclopropyl-3,3-dimethyl-2-oxoindole-6-carboxamide
SMILESCC1(C)C(=O)N(C2CC2)c2cc(C(N)=O)ccc21
InChIInChI=1S/C14H16N2O2/c1-14(2)10-6-3-8(12(15)17)7-11(10)16(13(14)18)9-4-5-9/h3,6-7,9H,4-5H2,1-2H3,(H2,15,17)
InChIKeySSNJMLMQYRSVET-UHFFFAOYSA-N
MW244.29 g/mol
LogP1.57
Rot. Bonds2

About 1-cyclopropyl-3,3-dimethyl-2-oxoindole-6-carboxamide

1-cyclopropyl-3,3-dimethyl-2-oxoindole-6-carboxamide (PubChem CID 125482166) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 1-cyclopropyl-3,3-dimethyl-2-oxoindole-6-carboxamide.

Molecular Properties

Compound Name1-cyclopropyl-3,3-dimethyl-2-oxoindole-6-carboxamide
PubChem CID125482166
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name1-cyclopropyl-3,3-dimethyl-2-oxoindole-6-carboxamide
SMILESCC1(C)C(=O)N(C2CC2)c2cc(C(N)=O)ccc21
InChIInChI=1S/C14H16N2O2/c1-14(2)10-6-3-8(12(15)17)7-11(10)16(13(14)18)9-4-5-9/h3,6-7,9H,4-5H2,1-2H3,(H2,15,17)
InChIKeySSNJMLMQYRSVET-UHFFFAOYSA-N
XLogP1.57
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3,3-dimethyl-2-oxoindole-6-carboxamide?
The IUPAC name of 1-cyclopropyl-3,3-dimethyl-2-oxoindole-6-carboxamide (CID 125482166) is 1-cyclopropyl-3,3-dimethyl-2-oxoindole-6-carboxamide.
What is the SMILES notation for 1-cyclopropyl-3,3-dimethyl-2-oxoindole-6-carboxamide?
The canonical SMILES for 1-cyclopropyl-3,3-dimethyl-2-oxoindole-6-carboxamide is CC1(C)C(=O)N(C2CC2)c2cc(C(N)=O)ccc21.
What is the InChIKey of 1-cyclopropyl-3,3-dimethyl-2-oxoindole-6-carboxamide?
The InChIKey is SSNJMLMQYRSVET-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-14(2)10-6-3-8(12(15)17)7-11(10)16(13(14)18)9-4-5-9/h3,6-7,9H,4-5H2,1-2H3,(H2,15,17).
What are the key properties of 1-cyclopropyl-3,3-dimethyl-2-oxoindole-6-carboxamide?
1-cyclopropyl-3,3-dimethyl-2-oxoindole-6-carboxamide has a molecular weight of 244.29 g/mol, XLogP of 1.57, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3,3-dimethyl-2-oxoindole-6-carboxamide is sourced from PubChem (CID 125482166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).