N-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-2-naphthalen-2-ylacetamide

C23H17N3O3 — CID 10872667

IUPACN-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-2-naphthalen-2-ylacetamide
SMILESO=C(Cc1ccc2ccccc2c1)Nc1ccc(-c2ccc3c(c2)OCO3)nn1
InChIInChI=1S/C23H17N3O3/c27-23(12-15-5-6-16-3-1-2-4-17(16)11-15)24-22-10-8-19(25-26-22)18-7-9-20-21(13-18)29-14-28-20/h1-11,13H,12,14H2,(H,24,26,27)
InChIKeyIMOWWCPHYDEZQE-UHFFFAOYSA-N
MW383.41 g/mol
LogP4.21
Rot. Bonds4

About N-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-2-naphthalen-2-ylacetamide

N-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-2-naphthalen-2-ylacetamide (PubChem CID 10872667) has the molecular formula C23H17N3O3 and a molecular weight of 383.41 g/mol. Its IUPAC name is N-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-2-naphthalen-2-ylacetamide.

Molecular Properties

Compound NameN-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-2-naphthalen-2-ylacetamide
PubChem CID10872667
Molecular FormulaC23H17N3O3
Molecular Weight383.41 g/mol
Exact Mass383.13
IUPAC NameN-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-2-naphthalen-2-ylacetamide
SMILESO=C(Cc1ccc2ccccc2c1)Nc1ccc(-c2ccc3c(c2)OCO3)nn1
InChIInChI=1S/C23H17N3O3/c27-23(12-15-5-6-16-3-1-2-4-17(16)11-15)24-22-10-8-19(25-26-22)18-7-9-20-21(13-18)29-14-28-20/h1-11,13H,12,14H2,(H,24,26,27)
InChIKeyIMOWWCPHYDEZQE-UHFFFAOYSA-N
XLogP4.21
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.41
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-2-naphthalen-2-ylacetamide 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

N-(6-acetyl-1,3-benzodioxol-5-yl)-2-naphthalen-2-ylacetamide
CID 31483361
N-[6-(1,3-benzodioxol-5-ylmethylamino)pyridazin-3-yl]-2-(2-fluorophenyl)acetamide
CID 113041856
N-[6-(1,3-benzodioxol-5-ylmethylamino)pyridazin-3-yl]-2-methylpropanamide
CID 113041820
4-N-(1,3-benzodioxol-5-ylmethyl)-6-naphthalen-2-ylpyrimidine-2,4-diamine
CID 176893682
N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-(4-methylphenyl)acetamide
CID 18198225
2-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]sulfanyl-N-(2-nitrophenyl)acetamide
CID 7672479
2-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]sulfanyl-N-(1,3-benzothiazol-2-yl)acetamide
CID 16813518
N-[3,5-bis[(2-naphthalen-2-ylacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide
CID 67257199
N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-(4-chlorophenyl)acetamide
CID 16911259
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-naphthalen-1-ylacetamide
CID 4235872
2-(1,3-benzodioxol-5-yl)-N-[4-(1,3-benzoxazol-2-yl)phenyl]acetamide
CID 41107745
N-[6-(1,3-benzodioxol-5-ylamino)pyridazin-3-yl]-3-phenylpropanamide
CID 113050236

Frequently Asked Questions

What is the IUPAC name of N-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-2-naphthalen-2-ylacetamide?
The IUPAC name of N-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-2-naphthalen-2-ylacetamide (CID 10872667) is N-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-2-naphthalen-2-ylacetamide.
What is the SMILES notation for N-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-2-naphthalen-2-ylacetamide?
The canonical SMILES for N-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-2-naphthalen-2-ylacetamide is O=C(Cc1ccc2ccccc2c1)Nc1ccc(-c2ccc3c(c2)OCO3)nn1.
What is the InChIKey of N-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-2-naphthalen-2-ylacetamide?
The InChIKey is IMOWWCPHYDEZQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17N3O3/c27-23(12-15-5-6-16-3-1-2-4-17(16)11-15)24-22-10-8-19(25-26-22)18-7-9-20-21(13-18)29-14-28-20/h1-11,13H,12,14H2,(H,24,26,27).
What are the key properties of N-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-2-naphthalen-2-ylacetamide?
N-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-2-naphthalen-2-ylacetamide has a molecular weight of 383.41 g/mol, XLogP of 4.21, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-2-naphthalen-2-ylacetamide is sourced from PubChem (CID 10872667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).