N-(6-ethylpyridazin-3-yl)-2-phenylacetamide

C14H15N3O — CID 123748541

IUPACN-(6-ethylpyridazin-3-yl)-2-phenylacetamide
SMILESCCc1ccc(NC(=O)Cc2ccccc2)nn1
InChIInChI=1S/C14H15N3O/c1-2-12-8-9-13(17-16-12)15-14(18)10-11-6-4-3-5-7-11/h3-9H,2,10H2,1H3,(H,15,17,18)
InChIKeyYPLIXGUEOSTENM-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.22
Rot. Bonds4

About N-(6-ethylpyridazin-3-yl)-2-phenylacetamide

N-(6-ethylpyridazin-3-yl)-2-phenylacetamide (PubChem CID 123748541) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is N-(6-ethylpyridazin-3-yl)-2-phenylacetamide.

Molecular Properties

Compound NameN-(6-ethylpyridazin-3-yl)-2-phenylacetamide
PubChem CID123748541
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC NameN-(6-ethylpyridazin-3-yl)-2-phenylacetamide
SMILESCCc1ccc(NC(=O)Cc2ccccc2)nn1
InChIInChI=1S/C14H15N3O/c1-2-12-8-9-13(17-16-12)15-14(18)10-11-6-4-3-5-7-11/h3-9H,2,10H2,1H3,(H,15,17,18)
InChIKeyYPLIXGUEOSTENM-UHFFFAOYSA-N
XLogP2.22
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(6-ethylpyridazin-3-yl)-2-phenylacetamide?
The IUPAC name of N-(6-ethylpyridazin-3-yl)-2-phenylacetamide (CID 123748541) is N-(6-ethylpyridazin-3-yl)-2-phenylacetamide.
What is the SMILES notation for N-(6-ethylpyridazin-3-yl)-2-phenylacetamide?
The canonical SMILES for N-(6-ethylpyridazin-3-yl)-2-phenylacetamide is CCc1ccc(NC(=O)Cc2ccccc2)nn1.
What is the InChIKey of N-(6-ethylpyridazin-3-yl)-2-phenylacetamide?
The InChIKey is YPLIXGUEOSTENM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-2-12-8-9-13(17-16-12)15-14(18)10-11-6-4-3-5-7-11/h3-9H,2,10H2,1H3,(H,15,17,18).
What are the key properties of N-(6-ethylpyridazin-3-yl)-2-phenylacetamide?
N-(6-ethylpyridazin-3-yl)-2-phenylacetamide has a molecular weight of 241.29 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-ethylpyridazin-3-yl)-2-phenylacetamide is sourced from PubChem (CID 123748541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).