9-acetylcarbazole-3,6-dicarbohydrazide

C16H15N5O3 — CID 174724830

IUPAC9-acetylcarbazole-3,6-dicarbohydrazide
SMILESCC(=O)n1c2ccc(C(=O)NN)cc2c2cc(C(=O)NN)ccc21
InChIInChI=1S/C16H15N5O3/c1-8(22)21-13-4-2-9(15(23)19-17)6-11(13)12-7-10(16(24)20-18)3-5-14(12)21/h2-7H,17-18H2,1H3,(H,19,23)(H,20,24)
InChIKeyVLFNSNBUJIHDED-UHFFFAOYSA-N
MW325.33 g/mol
LogP0.66
Rot. Bonds2

About 9-acetylcarbazole-3,6-dicarbohydrazide

9-acetylcarbazole-3,6-dicarbohydrazide (PubChem CID 174724830) has the molecular formula C16H15N5O3 and a molecular weight of 325.33 g/mol. Its IUPAC name is 9-acetylcarbazole-3,6-dicarbohydrazide.

Molecular Properties

Compound Name9-acetylcarbazole-3,6-dicarbohydrazide
PubChem CID174724830
Molecular FormulaC16H15N5O3
Molecular Weight325.33 g/mol
Exact Mass325.12
IUPAC Name9-acetylcarbazole-3,6-dicarbohydrazide
SMILESCC(=O)n1c2ccc(C(=O)NN)cc2c2cc(C(=O)NN)ccc21
InChIInChI=1S/C16H15N5O3/c1-8(22)21-13-4-2-9(15(23)19-17)6-11(13)12-7-10(16(24)20-18)3-5-14(12)21/h2-7H,17-18H2,1H3,(H,19,23)(H,20,24)
InChIKeyVLFNSNBUJIHDED-UHFFFAOYSA-N
XLogP0.66
TPSA132.24 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.33
LogP ≤ 50.66
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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'}

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Frequently Asked Questions

What is the IUPAC name of 9-acetylcarbazole-3,6-dicarbohydrazide?
The IUPAC name of 9-acetylcarbazole-3,6-dicarbohydrazide (CID 174724830) is 9-acetylcarbazole-3,6-dicarbohydrazide.
What is the SMILES notation for 9-acetylcarbazole-3,6-dicarbohydrazide?
The canonical SMILES for 9-acetylcarbazole-3,6-dicarbohydrazide is CC(=O)n1c2ccc(C(=O)NN)cc2c2cc(C(=O)NN)ccc21.
What is the InChIKey of 9-acetylcarbazole-3,6-dicarbohydrazide?
The InChIKey is VLFNSNBUJIHDED-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5O3/c1-8(22)21-13-4-2-9(15(23)19-17)6-11(13)12-7-10(16(24)20-18)3-5-14(12)21/h2-7H,17-18H2,1H3,(H,19,23)(H,20,24).
What are the key properties of 9-acetylcarbazole-3,6-dicarbohydrazide?
9-acetylcarbazole-3,6-dicarbohydrazide has a molecular weight of 325.33 g/mol, XLogP of 0.66, 2 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-acetylcarbazole-3,6-dicarbohydrazide is sourced from PubChem (CID 174724830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).