N'-[2-(1H-indol-3-yl)acetyl]naphthalene-2-carbohydrazide

C21H17N3O2 — CID 31828968

IUPACN'-[2-(1H-indol-3-yl)acetyl]naphthalene-2-carbohydrazide
SMILESO=C(Cc1c[nH]c2ccccc12)NNC(=O)c1ccc2ccccc2c1
InChIInChI=1S/C21H17N3O2/c25-20(12-17-13-22-19-8-4-3-7-18(17)19)23-24-21(26)16-10-9-14-5-1-2-6-15(14)11-16/h1-11,13,22H,12H2,(H,23,25)(H,24,26)
InChIKeyZAFGTQVNNHADJX-UHFFFAOYSA-N
MW343.39 g/mol
LogP3.32
Rot. Bonds3

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

N'-[2-(1H-indol-3-yl)acetyl]naphthalene-2-carbohydrazide (PubChem CID 31828968) has the molecular formula C21H17N3O2 and a molecular weight of 343.39 g/mol. Its IUPAC name is N'-[2-(1H-indol-3-yl)acetyl]naphthalene-2-carbohydrazide.

Molecular Properties

Compound NameN'-[2-(1H-indol-3-yl)acetyl]naphthalene-2-carbohydrazide
PubChem CID31828968
Molecular FormulaC21H17N3O2
Molecular Weight343.39 g/mol
Exact Mass343.13
IUPAC NameN'-[2-(1H-indol-3-yl)acetyl]naphthalene-2-carbohydrazide
SMILESO=C(Cc1c[nH]c2ccccc12)NNC(=O)c1ccc2ccccc2c1
InChIInChI=1S/C21H17N3O2/c25-20(12-17-13-22-19-8-4-3-7-18(17)19)23-24-21(26)16-10-9-14-5-1-2-6-15(14)11-16/h1-11,13,22H,12H2,(H,23,25)(H,24,26)
InChIKeyZAFGTQVNNHADJX-UHFFFAOYSA-N
XLogP3.32
TPSA73.99 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.39
LogP ≤ 53.32
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]-1-benzothiophene-2-carbohydrazide
CID 32754732
3-(benzenesulfonylmethyl)-N'-[2-(1H-indol-3-yl)acetyl]benzohydrazide
CID 46490610
N'-[2-(1H-indol-3-yl)acetyl]-2-methylbenzohydrazide
CID 39972640
2-(1H-indol-3-yl)-N-[(1S)-1-naphthalen-2-ylethyl]acetamide
CID 40810685
N'-[2-(1H-indol-3-yl)acetyl]-4-(2,2,2-trifluoroethoxymethyl)benzohydrazide
CID 18269145
N'-[2-(1H-indol-3-yl)acetyl]-4-(oxolan-2-ylmethoxy)benzohydrazide
CID 102603532
3-[[[2-(1H-indol-3-yl)acetyl]amino]carbamoyl]-N-propan-2-ylbenzenesulfonamide
CID 26932806
N'-[2-(1H-indol-3-yl)acetyl]-3-methyltriazole-4-carbohydrazide
CID 100694106
N'-[3-(1H-indol-3-yl)propanoyl]benzohydrazide
CID 2086054
N-[3-[2-[2-(1H-indol-3-yl)acetyl]hydrazinyl]-3-oxopropyl]benzamide
CID 26933063
N'-[2-(1H-indol-3-yl)acetyl]-2-(phenoxymethyl)benzohydrazide
CID 24517687
N'-[2-(1H-indol-3-yl)acetyl]-2,4-dimethoxybenzohydrazide
CID 51166893

Frequently Asked Questions

What is the IUPAC name of N'-[2-(1H-indol-3-yl)acetyl]naphthalene-2-carbohydrazide?
The IUPAC name of N'-[2-(1H-indol-3-yl)acetyl]naphthalene-2-carbohydrazide (CID 31828968) is N'-[2-(1H-indol-3-yl)acetyl]naphthalene-2-carbohydrazide.
What is the SMILES notation for N'-[2-(1H-indol-3-yl)acetyl]naphthalene-2-carbohydrazide?
The canonical SMILES for N'-[2-(1H-indol-3-yl)acetyl]naphthalene-2-carbohydrazide is O=C(Cc1c[nH]c2ccccc12)NNC(=O)c1ccc2ccccc2c1.
What is the InChIKey of N'-[2-(1H-indol-3-yl)acetyl]naphthalene-2-carbohydrazide?
The InChIKey is ZAFGTQVNNHADJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N3O2/c25-20(12-17-13-22-19-8-4-3-7-18(17)19)23-24-21(26)16-10-9-14-5-1-2-6-15(14)11-16/h1-11,13,22H,12H2,(H,23,25)(H,24,26).
What are the key properties of N'-[2-(1H-indol-3-yl)acetyl]naphthalene-2-carbohydrazide?
N'-[2-(1H-indol-3-yl)acetyl]naphthalene-2-carbohydrazide has a molecular weight of 343.39 g/mol, XLogP of 3.32, 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]naphthalene-2-carbohydrazide is sourced from PubChem (CID 31828968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).