N'-[2-(1H-indol-3-yl)acetyl]-1,2-dihydroacenaphthylene-5-carbohydrazide

C23H19N3O2 — CID 24559782

IUPACN'-[2-(1H-indol-3-yl)acetyl]-1,2-dihydroacenaphthylene-5-carbohydrazide
SMILESO=C(Cc1c[nH]c2ccccc12)NNC(=O)c1ccc2c3c(cccc13)CC2
InChIInChI=1S/C23H19N3O2/c27-21(12-16-13-24-20-7-2-1-5-17(16)20)25-26-23(28)19-11-10-15-9-8-14-4-3-6-18(19)22(14)15/h1-7,10-11,13,24H,8-9,12H2,(H,25,27)(H,26,28)
InChIKeyMZJPMKUDWRUPNO-UHFFFAOYSA-N
MW369.42 g/mol
LogP3.42
Rot. Bonds3

About N'-[2-(1H-indol-3-yl)acetyl]-1,2-dihydroacenaphthylene-5-carbohydrazide

N'-[2-(1H-indol-3-yl)acetyl]-1,2-dihydroacenaphthylene-5-carbohydrazide (PubChem CID 24559782) has the molecular formula C23H19N3O2 and a molecular weight of 369.42 g/mol. Its IUPAC name is N'-[2-(1H-indol-3-yl)acetyl]-1,2-dihydroacenaphthylene-5-carbohydrazide.

Molecular Properties

Compound NameN'-[2-(1H-indol-3-yl)acetyl]-1,2-dihydroacenaphthylene-5-carbohydrazide
PubChem CID24559782
Molecular FormulaC23H19N3O2
Molecular Weight369.42 g/mol
Exact Mass369.15
IUPAC NameN'-[2-(1H-indol-3-yl)acetyl]-1,2-dihydroacenaphthylene-5-carbohydrazide
SMILESO=C(Cc1c[nH]c2ccccc12)NNC(=O)c1ccc2c3c(cccc13)CC2
InChIInChI=1S/C23H19N3O2/c27-21(12-16-13-24-20-7-2-1-5-17(16)20)25-26-23(28)19-11-10-15-9-8-14-4-3-6-18(19)22(14)15/h1-7,10-11,13,24H,8-9,12H2,(H,25,27)(H,26,28)
InChIKeyMZJPMKUDWRUPNO-UHFFFAOYSA-N
XLogP3.42
TPSA73.99 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.42
LogP ≤ 53.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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-methylbenzohydrazide
CID 39972640
2-anilino-N'-[2-(1H-indol-3-yl)acetyl]benzohydrazide
CID 31828855
N'-[2-(1H-indol-3-yl)acetyl]-2-(trifluoromethyl)benzohydrazide
CID 32742935
N'-[2-(1H-indol-3-yl)acetyl]naphthalene-2-carbohydrazide
CID 31828968
N'-[2-(1H-indol-3-yl)acetyl]-2-(phenoxymethyl)benzohydrazide
CID 24517687
N'-[2-(1H-indol-3-yl)acetyl]-2,4-dimethoxybenzohydrazide
CID 51166893
N-[3-[2-[2-(1H-indol-3-yl)acetyl]hydrazinyl]-3-oxopropyl]benzamide
CID 26933063
4-(1H-indol-3-yl)-N'-[2-(1H-indol-3-yl)acetyl]butanehydrazide
CID 29437828
N'-[2-(1H-indol-3-yl)acetyl]cyclobutanecarbohydrazide
CID 29437842
2-(3-fluorophenyl)-N'-[2-(1H-indol-3-yl)acetyl]acetohydrazide
CID 31772931
N-hydroxy-2-(1H-indol-3-yl)acetamide
CID 13058633
1-[[2-(1H-indol-3-yl)acetyl]amino]-3-phenylurea
CID 5058781

Frequently Asked Questions

What is the IUPAC name of N'-[2-(1H-indol-3-yl)acetyl]-1,2-dihydroacenaphthylene-5-carbohydrazide?
The IUPAC name of N'-[2-(1H-indol-3-yl)acetyl]-1,2-dihydroacenaphthylene-5-carbohydrazide (CID 24559782) is N'-[2-(1H-indol-3-yl)acetyl]-1,2-dihydroacenaphthylene-5-carbohydrazide.
What is the SMILES notation for N'-[2-(1H-indol-3-yl)acetyl]-1,2-dihydroacenaphthylene-5-carbohydrazide?
The canonical SMILES for N'-[2-(1H-indol-3-yl)acetyl]-1,2-dihydroacenaphthylene-5-carbohydrazide is O=C(Cc1c[nH]c2ccccc12)NNC(=O)c1ccc2c3c(cccc13)CC2.
What is the InChIKey of N'-[2-(1H-indol-3-yl)acetyl]-1,2-dihydroacenaphthylene-5-carbohydrazide?
The InChIKey is MZJPMKUDWRUPNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O2/c27-21(12-16-13-24-20-7-2-1-5-17(16)20)25-26-23(28)19-11-10-15-9-8-14-4-3-6-18(19)22(14)15/h1-7,10-11,13,24H,8-9,12H2,(H,25,27)(H,26,28).
What are the key properties of N'-[2-(1H-indol-3-yl)acetyl]-1,2-dihydroacenaphthylene-5-carbohydrazide?
N'-[2-(1H-indol-3-yl)acetyl]-1,2-dihydroacenaphthylene-5-carbohydrazide has a molecular weight of 369.42 g/mol, XLogP of 3.42, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(1H-indol-3-yl)acetyl]-1,2-dihydroacenaphthylene-5-carbohydrazide is sourced from PubChem (CID 24559782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).