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

C14H17N3O2 — CID 116848329

IUPACN',N'-dimethyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide
SMILESCN(C)NC(=O)C1(c2ccc3c(c2)CC(=O)N3)CC1
InChIInChI=1S/C14H17N3O2/c1-17(2)16-13(19)14(5-6-14)10-3-4-11-9(7-10)8-12(18)15-11/h3-4,7H,5-6,8H2,1-2H3,(H,15,18)(H,16,19)
InChIKeyIFPFNFQIUSNYHZ-UHFFFAOYSA-N
MW259.31 g/mol
LogP0.81
Rot. Bonds3

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

N',N'-dimethyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide (PubChem CID 116848329) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N',N'-dimethyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide.

Molecular Properties

Compound NameN',N'-dimethyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide
PubChem CID116848329
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN',N'-dimethyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide
SMILESCN(C)NC(=O)C1(c2ccc3c(c2)CC(=O)N3)CC1
InChIInChI=1S/C14H17N3O2/c1-17(2)16-13(19)14(5-6-14)10-3-4-11-9(7-10)8-12(18)15-11/h3-4,7H,5-6,8H2,1-2H3,(H,15,18)(H,16,19)
InChIKeyIFPFNFQIUSNYHZ-UHFFFAOYSA-N
XLogP0.81
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N',N'-dimethyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide?
The IUPAC name of N',N'-dimethyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide (CID 116848329) is N',N'-dimethyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide.
What is the SMILES notation for N',N'-dimethyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide?
The canonical SMILES for N',N'-dimethyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide is CN(C)NC(=O)C1(c2ccc3c(c2)CC(=O)N3)CC1.
What is the InChIKey of N',N'-dimethyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide?
The InChIKey is IFPFNFQIUSNYHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-17(2)16-13(19)14(5-6-14)10-3-4-11-9(7-10)8-12(18)15-11/h3-4,7H,5-6,8H2,1-2H3,(H,15,18)(H,16,19).
What are the key properties of N',N'-dimethyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide?
N',N'-dimethyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide has a molecular weight of 259.31 g/mol, XLogP of 0.81, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dimethyl-1-(2-oxo-1,3-dihydroindol-5-yl)cyclopropane-1-carbohydrazide is sourced from PubChem (CID 116848329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).