2-(1H-indol-3-yl)-N-[6-(2-phenylethylamino)pyridazin-3-yl]acetamide

C22H21N5O — CID 113042337

IUPAC2-(1H-indol-3-yl)-N-[6-(2-phenylethylamino)pyridazin-3-yl]acetamide
SMILESO=C(Cc1c[nH]c2ccccc12)Nc1ccc(NCCc2ccccc2)nn1
InChIInChI=1S/C22H21N5O/c28-22(14-17-15-24-19-9-5-4-8-18(17)19)25-21-11-10-20(26-27-21)23-13-12-16-6-2-1-3-7-16/h1-11,15,24H,12-14H2,(H,23,26)(H,25,27,28)
InChIKeySFZUVBNNRINHTR-UHFFFAOYSA-N
MW371.44 g/mol
LogP3.79
Rot. Bonds7

About 2-(1H-indol-3-yl)-N-[6-(2-phenylethylamino)pyridazin-3-yl]acetamide

2-(1H-indol-3-yl)-N-[6-(2-phenylethylamino)pyridazin-3-yl]acetamide (PubChem CID 113042337) has the molecular formula C22H21N5O and a molecular weight of 371.44 g/mol. Its IUPAC name is 2-(1H-indol-3-yl)-N-[6-(2-phenylethylamino)pyridazin-3-yl]acetamide.

Molecular Properties

Compound Name2-(1H-indol-3-yl)-N-[6-(2-phenylethylamino)pyridazin-3-yl]acetamide
PubChem CID113042337
Molecular FormulaC22H21N5O
Molecular Weight371.44 g/mol
Exact Mass371.17
IUPAC Name2-(1H-indol-3-yl)-N-[6-(2-phenylethylamino)pyridazin-3-yl]acetamide
SMILESO=C(Cc1c[nH]c2ccccc12)Nc1ccc(NCCc2ccccc2)nn1
InChIInChI=1S/C22H21N5O/c28-22(14-17-15-24-19-9-5-4-8-18(17)19)25-21-11-10-20(26-27-21)23-13-12-16-6-2-1-3-7-16/h1-11,15,24H,12-14H2,(H,23,26)(H,25,27,28)
InChIKeySFZUVBNNRINHTR-UHFFFAOYSA-N
XLogP3.79
TPSA82.70 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 53.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-(1H-indol-3-yl)-N-[6-(2-phenylethylamino)pyridazin-3-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-fluoro-N-[6-[2-(1H-indol-3-yl)ethylamino]pyridazin-3-yl]benzamide
CID 113043194
2-ethyl-N-[6-[2-(1H-indol-3-yl)ethylamino]pyridazin-3-yl]butanamide
CID 113043185
N-[6-(2-chloroanilino)pyridazin-3-yl]-2-(1H-indol-3-yl)acetamide
CID 113047370
2-(1H-indol-3-yl)-N-[6-(4-methylanilino)pyridazin-3-yl]acetamide
CID 113045828
N-[6-(2-ethylanilino)pyridazin-3-yl]-2-(1H-indol-3-yl)acetamide
CID 113046653
4-[2-[[2-(1H-indol-3-yl)acetyl]amino]ethyl]benzoic acid
CID 71900120
2-[2-(1H-indol-3-yl)ethylamino]-N-(2-phenylethyl)acetamide
CID 108999978
2-(1H-indol-3-yl)-N-[6-[(5-methyl-1,2-oxazol-3-yl)amino]pyridazin-3-yl]acetamide
CID 113051735
N-[2-(4-hydroxyphenyl)ethyl]-2-(1H-indol-3-yl)acetamide
CID 7097288
4-[[2-(1H-indol-3-yl)acetyl]amino]thiophene-3-carboxamide
CID 126852042
6-(2-phenylethylamino)pyridazine-3-carboxylic acid
CID 10332018
6-(benzenesulfonyl)-N-[2-(1H-indol-3-yl)ethyl]pyridazin-3-amine
CID 27375773

Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-3-yl)-N-[6-(2-phenylethylamino)pyridazin-3-yl]acetamide?
The IUPAC name of 2-(1H-indol-3-yl)-N-[6-(2-phenylethylamino)pyridazin-3-yl]acetamide (CID 113042337) is 2-(1H-indol-3-yl)-N-[6-(2-phenylethylamino)pyridazin-3-yl]acetamide.
What is the SMILES notation for 2-(1H-indol-3-yl)-N-[6-(2-phenylethylamino)pyridazin-3-yl]acetamide?
The canonical SMILES for 2-(1H-indol-3-yl)-N-[6-(2-phenylethylamino)pyridazin-3-yl]acetamide is O=C(Cc1c[nH]c2ccccc12)Nc1ccc(NCCc2ccccc2)nn1.
What is the InChIKey of 2-(1H-indol-3-yl)-N-[6-(2-phenylethylamino)pyridazin-3-yl]acetamide?
The InChIKey is SFZUVBNNRINHTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N5O/c28-22(14-17-15-24-19-9-5-4-8-18(17)19)25-21-11-10-20(26-27-21)23-13-12-16-6-2-1-3-7-16/h1-11,15,24H,12-14H2,(H,23,26)(H,25,27,28).
What are the key properties of 2-(1H-indol-3-yl)-N-[6-(2-phenylethylamino)pyridazin-3-yl]acetamide?
2-(1H-indol-3-yl)-N-[6-(2-phenylethylamino)pyridazin-3-yl]acetamide has a molecular weight of 371.44 g/mol, XLogP of 3.79, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-3-yl)-N-[6-(2-phenylethylamino)pyridazin-3-yl]acetamide is sourced from PubChem (CID 113042337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).