6-chloro-N'-[2-(1H-indol-3-yl)acetyl]quinoline-8-carbohydrazide

C20H15ClN4O2 — CID 55881068

IUPAC6-chloro-N'-[2-(1H-indol-3-yl)acetyl]quinoline-8-carbohydrazide
SMILESO=C(Cc1c[nH]c2ccccc12)NNC(=O)c1cc(Cl)cc2cccnc12
InChIInChI=1S/C20H15ClN4O2/c21-14-8-12-4-3-7-22-19(12)16(10-14)20(27)25-24-18(26)9-13-11-23-17-6-2-1-5-15(13)17/h1-8,10-11,23H,9H2,(H,24,26)(H,25,27)
InChIKeyJDLKIHMFPPAITL-UHFFFAOYSA-N
MW378.82 g/mol
LogP3.37
Rot. Bonds3

About 6-chloro-N'-[2-(1H-indol-3-yl)acetyl]quinoline-8-carbohydrazide

6-chloro-N'-[2-(1H-indol-3-yl)acetyl]quinoline-8-carbohydrazide (PubChem CID 55881068) has the molecular formula C20H15ClN4O2 and a molecular weight of 378.82 g/mol. Its IUPAC name is 6-chloro-N'-[2-(1H-indol-3-yl)acetyl]quinoline-8-carbohydrazide.

Molecular Properties

Compound Name6-chloro-N'-[2-(1H-indol-3-yl)acetyl]quinoline-8-carbohydrazide
PubChem CID55881068
Molecular FormulaC20H15ClN4O2
Molecular Weight378.82 g/mol
Exact Mass378.09
IUPAC Name6-chloro-N'-[2-(1H-indol-3-yl)acetyl]quinoline-8-carbohydrazide
SMILESO=C(Cc1c[nH]c2ccccc12)NNC(=O)c1cc(Cl)cc2cccnc12
InChIInChI=1S/C20H15ClN4O2/c21-14-8-12-4-3-7-22-19(12)16(10-14)20(27)25-24-18(26)9-13-11-23-17-6-2-1-5-15(13)17/h1-8,10-11,23H,9H2,(H,24,26)(H,25,27)
InChIKeyJDLKIHMFPPAITL-UHFFFAOYSA-N
XLogP3.37
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.82
LogP ≤ 53.37
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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Related Compounds

N'-[2-(1H-indol-3-yl)acetyl]-2-phenoxypyridine-3-carbohydrazide
CID 31800805
N'-[2-(1H-indol-3-yl)acetyl]naphthalene-2-carbohydrazide
CID 31828968
N'-[2-(1H-indol-3-yl)acetyl]-2-methylbenzohydrazide
CID 39972640
N'-[2-(1H-indol-3-yl)acetyl]-2-(trifluoromethyl)benzohydrazide
CID 32742935
2-(3-bromophenoxy)-N'-[2-(1H-indol-3-yl)acetyl]pyridine-3-carbohydrazide
CID 46490653
N-[2-(1H-indol-3-yl)ethyl]-2-quinolin-8-ylacetamide
CID 51320623
N-(2-chloro-3-pyridinyl)-2-(1H-indol-3-yl)acetamide
CID 10869874
N'-[2-(1H-indol-3-yl)acetyl]-2-(phenoxymethyl)benzohydrazide
CID 24517687
N'-[2-(1H-indol-3-yl)acetyl]-1-benzothiophene-2-carbohydrazide
CID 32754732
2-anilino-N'-[2-(1H-indol-3-yl)acetyl]benzohydrazide
CID 31828855
N'-[2-(2,5-dichlorophenoxy)acetyl]-2-(1H-indol-3-yl)acetohydrazide
CID 24563218
2-chloro-N'-(2-quinolin-8-ylacetyl)benzohydrazide
CID 24662624

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N'-[2-(1H-indol-3-yl)acetyl]quinoline-8-carbohydrazide?
The IUPAC name of 6-chloro-N'-[2-(1H-indol-3-yl)acetyl]quinoline-8-carbohydrazide (CID 55881068) is 6-chloro-N'-[2-(1H-indol-3-yl)acetyl]quinoline-8-carbohydrazide.
What is the SMILES notation for 6-chloro-N'-[2-(1H-indol-3-yl)acetyl]quinoline-8-carbohydrazide?
The canonical SMILES for 6-chloro-N'-[2-(1H-indol-3-yl)acetyl]quinoline-8-carbohydrazide is O=C(Cc1c[nH]c2ccccc12)NNC(=O)c1cc(Cl)cc2cccnc12.
What is the InChIKey of 6-chloro-N'-[2-(1H-indol-3-yl)acetyl]quinoline-8-carbohydrazide?
The InChIKey is JDLKIHMFPPAITL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClN4O2/c21-14-8-12-4-3-7-22-19(12)16(10-14)20(27)25-24-18(26)9-13-11-23-17-6-2-1-5-15(13)17/h1-8,10-11,23H,9H2,(H,24,26)(H,25,27).
What are the key properties of 6-chloro-N'-[2-(1H-indol-3-yl)acetyl]quinoline-8-carbohydrazide?
6-chloro-N'-[2-(1H-indol-3-yl)acetyl]quinoline-8-carbohydrazide has a molecular weight of 378.82 g/mol, XLogP of 3.37, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N'-[2-(1H-indol-3-yl)acetyl]quinoline-8-carbohydrazide is sourced from PubChem (CID 55881068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).