N-(cyclopropylmethyl)-2-(7-fluoro-5-methyl-2,3-dioxoindol-1-yl)acetamide

C15H15FN2O3 — CID 61356957

IUPACN-(cyclopropylmethyl)-2-(7-fluoro-5-methyl-2,3-dioxoindol-1-yl)acetamide
SMILESCc1cc(F)c2c(c1)C(=O)C(=O)N2CC(=O)NCC1CC1
InChIInChI=1S/C15H15FN2O3/c1-8-4-10-13(11(16)5-8)18(15(21)14(10)20)7-12(19)17-6-9-2-3-9/h4-5,9H,2-3,6-7H2,1H3,(H,17,19)
InChIKeyOTFIAICNAXFOMD-UHFFFAOYSA-N
MW290.29 g/mol
LogP1.19
Rot. Bonds4

About N-(cyclopropylmethyl)-2-(7-fluoro-5-methyl-2,3-dioxoindol-1-yl)acetamide

N-(cyclopropylmethyl)-2-(7-fluoro-5-methyl-2,3-dioxoindol-1-yl)acetamide (PubChem CID 61356957) has the molecular formula C15H15FN2O3 and a molecular weight of 290.29 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-(7-fluoro-5-methyl-2,3-dioxoindol-1-yl)acetamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-(7-fluoro-5-methyl-2,3-dioxoindol-1-yl)acetamide
PubChem CID61356957
Molecular FormulaC15H15FN2O3
Molecular Weight290.29 g/mol
Exact Mass290.11
IUPAC NameN-(cyclopropylmethyl)-2-(7-fluoro-5-methyl-2,3-dioxoindol-1-yl)acetamide
SMILESCc1cc(F)c2c(c1)C(=O)C(=O)N2CC(=O)NCC1CC1
InChIInChI=1S/C15H15FN2O3/c1-8-4-10-13(11(16)5-8)18(15(21)14(10)20)7-12(19)17-6-9-2-3-9/h4-5,9H,2-3,6-7H2,1H3,(H,17,19)
InChIKeyOTFIAICNAXFOMD-UHFFFAOYSA-N
XLogP1.19
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.29
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(cyclopropylmethyl)-2-(7-fluoro-5-methyl-2,3-dioxoindol-1-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-(7-fluoro-5-methyl-2,3-dioxoindol-1-yl)acetamide?
The IUPAC name of N-(cyclopropylmethyl)-2-(7-fluoro-5-methyl-2,3-dioxoindol-1-yl)acetamide (CID 61356957) is N-(cyclopropylmethyl)-2-(7-fluoro-5-methyl-2,3-dioxoindol-1-yl)acetamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-(7-fluoro-5-methyl-2,3-dioxoindol-1-yl)acetamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-(7-fluoro-5-methyl-2,3-dioxoindol-1-yl)acetamide is Cc1cc(F)c2c(c1)C(=O)C(=O)N2CC(=O)NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-2-(7-fluoro-5-methyl-2,3-dioxoindol-1-yl)acetamide?
The InChIKey is OTFIAICNAXFOMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O3/c1-8-4-10-13(11(16)5-8)18(15(21)14(10)20)7-12(19)17-6-9-2-3-9/h4-5,9H,2-3,6-7H2,1H3,(H,17,19).
What are the key properties of N-(cyclopropylmethyl)-2-(7-fluoro-5-methyl-2,3-dioxoindol-1-yl)acetamide?
N-(cyclopropylmethyl)-2-(7-fluoro-5-methyl-2,3-dioxoindol-1-yl)acetamide has a molecular weight of 290.29 g/mol, XLogP of 1.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-(7-fluoro-5-methyl-2,3-dioxoindol-1-yl)acetamide is sourced from PubChem (CID 61356957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).