N-(1-methylindazol-6-yl)-5-oxopyrrolidine-2-carboxamide

C13H14N4O2 — CID 110462131

IUPACN-(1-methylindazol-6-yl)-5-oxopyrrolidine-2-carboxamide
SMILESCn1ncc2ccc(NC(=O)C3CCC(=O)N3)cc21
InChIInChI=1S/C13H14N4O2/c1-17-11-6-9(3-2-8(11)7-14-17)15-13(19)10-4-5-12(18)16-10/h2-3,6-7,10H,4-5H2,1H3,(H,15,19)(H,16,18)
InChIKeyAKWZFJRFXCLSKL-UHFFFAOYSA-N
MW258.28 g/mol
LogP0.79
Rot. Bonds2

About N-(1-methylindazol-6-yl)-5-oxopyrrolidine-2-carboxamide

N-(1-methylindazol-6-yl)-5-oxopyrrolidine-2-carboxamide (PubChem CID 110462131) has the molecular formula C13H14N4O2 and a molecular weight of 258.28 g/mol. Its IUPAC name is N-(1-methylindazol-6-yl)-5-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(1-methylindazol-6-yl)-5-oxopyrrolidine-2-carboxamide
PubChem CID110462131
Molecular FormulaC13H14N4O2
Molecular Weight258.28 g/mol
Exact Mass258.11
IUPAC NameN-(1-methylindazol-6-yl)-5-oxopyrrolidine-2-carboxamide
SMILESCn1ncc2ccc(NC(=O)C3CCC(=O)N3)cc21
InChIInChI=1S/C13H14N4O2/c1-17-11-6-9(3-2-8(11)7-14-17)15-13(19)10-4-5-12(18)16-10/h2-3,6-7,10H,4-5H2,1H3,(H,15,19)(H,16,18)
InChIKeyAKWZFJRFXCLSKL-UHFFFAOYSA-N
XLogP0.79
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(1-methylindazol-6-yl)-5-oxopyrrolidine-2-carboxamide 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-(1-methylindazol-6-yl)-5-oxopyrrolidine-2-carboxamide?
The IUPAC name of N-(1-methylindazol-6-yl)-5-oxopyrrolidine-2-carboxamide (CID 110462131) is N-(1-methylindazol-6-yl)-5-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for N-(1-methylindazol-6-yl)-5-oxopyrrolidine-2-carboxamide?
The canonical SMILES for N-(1-methylindazol-6-yl)-5-oxopyrrolidine-2-carboxamide is Cn1ncc2ccc(NC(=O)C3CCC(=O)N3)cc21.
What is the InChIKey of N-(1-methylindazol-6-yl)-5-oxopyrrolidine-2-carboxamide?
The InChIKey is AKWZFJRFXCLSKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O2/c1-17-11-6-9(3-2-8(11)7-14-17)15-13(19)10-4-5-12(18)16-10/h2-3,6-7,10H,4-5H2,1H3,(H,15,19)(H,16,18).
What are the key properties of N-(1-methylindazol-6-yl)-5-oxopyrrolidine-2-carboxamide?
N-(1-methylindazol-6-yl)-5-oxopyrrolidine-2-carboxamide has a molecular weight of 258.28 g/mol, XLogP of 0.79, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylindazol-6-yl)-5-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 110462131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).