N-methyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide

C13H15N3O2 — CID 116846053

IUPACN-methyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide
SMILESCN(N)C(=O)C1(c2ccc3c(c2)CC(=O)N3)CC1
InChIInChI=1S/C13H15N3O2/c1-16(14)12(18)13(4-5-13)9-2-3-10-8(6-9)7-11(17)15-10/h2-3,6H,4-5,7,14H2,1H3,(H,15,17)
InChIKeyAOAKMCNXCNUDEU-UHFFFAOYSA-N
MW245.28 g/mol
LogP0.54
Rot. Bonds2

About N-methyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide

N-methyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide (PubChem CID 116846053) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is N-methyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide.

Molecular Properties

Compound NameN-methyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide
PubChem CID116846053
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC NameN-methyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide
SMILESCN(N)C(=O)C1(c2ccc3c(c2)CC(=O)N3)CC1
InChIInChI=1S/C13H15N3O2/c1-16(14)12(18)13(4-5-13)9-2-3-10-8(6-9)7-11(17)15-10/h2-3,6H,4-5,7,14H2,1H3,(H,15,17)
InChIKeyAOAKMCNXCNUDEU-UHFFFAOYSA-N
XLogP0.54
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-methyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide with MolForge

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

Launch Full Analysis

Related Compounds

N',N'-dimethyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide
CID 116848329
N-methyl-2-(2-oxo-1,3-dihydroindol-5-yl)acetohydrazide
CID 116844796
methyl 3-(2-oxo-1,3-dihydroindol-5-yl)oxetane-3-carboxylate
CID 116873514
N-methyl-1-phenylcyclopropane-1-carbohydrazide
CID 116846008
5-(1-hydroxy-4-oxocyclohexyl)-1,3-dihydroindol-2-one
CID 141283388
1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-methylcyclopropane-1-carbohydrazide
CID 116846036
5-(3-aminooxetan-3-yl)-1,3-dihydroindol-2-one
CID 116872639
ethane;5-methyl-1,3-dihydroindol-2-one
CID 91234498
5-[1-(aminomethyl)cyclohexyl]-1,3-dihydroindol-2-one
CID 82497597
5-(3-hydroxyoxetan-3-yl)-1,3-dihydroindol-2-one
CID 116872972
2-(2-oxo-1,3-dihydroindol-5-yl)acetamide
CID 82490915
2-[methyl-(2-oxo-1,3-dihydroindol-5-yl)amino]-2-oxoacetic acid
CID 115141221

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide?
The IUPAC name of N-methyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide (CID 116846053) is N-methyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide.
What is the SMILES notation for N-methyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide?
The canonical SMILES for N-methyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide is CN(N)C(=O)C1(c2ccc3c(c2)CC(=O)N3)CC1.
What is the InChIKey of N-methyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide?
The InChIKey is AOAKMCNXCNUDEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-16(14)12(18)13(4-5-13)9-2-3-10-8(6-9)7-11(17)15-10/h2-3,6H,4-5,7,14H2,1H3,(H,15,17).
What are the key properties of N-methyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide?
N-methyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide has a molecular weight of 245.28 g/mol, XLogP of 0.54, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide is sourced from PubChem (CID 116846053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).