N'-(cyclopropanecarbonyl)-1H-indazole-3-carbohydrazide

C12H12N4O2 — CID 26799017

IUPACN'-(cyclopropanecarbonyl)-1H-indazole-3-carbohydrazide
SMILESO=C(NNC(=O)C1CC1)c1n[nH]c2ccccc12
InChIInChI=1S/C12H12N4O2/c17-11(7-5-6-7)15-16-12(18)10-8-3-1-2-4-9(8)13-14-10/h1-4,7H,5-6H2,(H,13,14)(H,15,17)(H,16,18)
InChIKeyCYBSLQZXASSSLZ-UHFFFAOYSA-N
MW244.25 g/mol
LogP0.73
Rot. Bonds2

About N'-(cyclopropanecarbonyl)-1H-indazole-3-carbohydrazide

N'-(cyclopropanecarbonyl)-1H-indazole-3-carbohydrazide (PubChem CID 26799017) has the molecular formula C12H12N4O2 and a molecular weight of 244.25 g/mol. Its IUPAC name is N'-(cyclopropanecarbonyl)-1H-indazole-3-carbohydrazide.

Molecular Properties

Compound NameN'-(cyclopropanecarbonyl)-1H-indazole-3-carbohydrazide
PubChem CID26799017
Molecular FormulaC12H12N4O2
Molecular Weight244.25 g/mol
Exact Mass244.10
IUPAC NameN'-(cyclopropanecarbonyl)-1H-indazole-3-carbohydrazide
SMILESO=C(NNC(=O)C1CC1)c1n[nH]c2ccccc12
InChIInChI=1S/C12H12N4O2/c17-11(7-5-6-7)15-16-12(18)10-8-3-1-2-4-9(8)13-14-10/h1-4,7H,5-6H2,(H,13,14)(H,15,17)(H,16,18)
InChIKeyCYBSLQZXASSSLZ-UHFFFAOYSA-N
XLogP0.73
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.25
LogP ≤ 50.73
H-Bond Donors ≤ 53
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'-(cyclopropanecarbonyl)-1H-indazole-3-carbohydrazide?
The IUPAC name of N'-(cyclopropanecarbonyl)-1H-indazole-3-carbohydrazide (CID 26799017) is N'-(cyclopropanecarbonyl)-1H-indazole-3-carbohydrazide.
What is the SMILES notation for N'-(cyclopropanecarbonyl)-1H-indazole-3-carbohydrazide?
The canonical SMILES for N'-(cyclopropanecarbonyl)-1H-indazole-3-carbohydrazide is O=C(NNC(=O)C1CC1)c1n[nH]c2ccccc12.
What is the InChIKey of N'-(cyclopropanecarbonyl)-1H-indazole-3-carbohydrazide?
The InChIKey is CYBSLQZXASSSLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4O2/c17-11(7-5-6-7)15-16-12(18)10-8-3-1-2-4-9(8)13-14-10/h1-4,7H,5-6H2,(H,13,14)(H,15,17)(H,16,18).
What are the key properties of N'-(cyclopropanecarbonyl)-1H-indazole-3-carbohydrazide?
N'-(cyclopropanecarbonyl)-1H-indazole-3-carbohydrazide has a molecular weight of 244.25 g/mol, XLogP of 0.73, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(cyclopropanecarbonyl)-1H-indazole-3-carbohydrazide is sourced from PubChem (CID 26799017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).