N-[2-(dimethylamino)ethyl]-2-[3-(1-ethyl-6-oxopyridazin-3-yl)phenyl]acetamide

C18H24N4O2 — CID 71248336

IUPACN-[2-(dimethylamino)ethyl]-2-[3-(1-ethyl-6-oxopyridazin-3-yl)phenyl]acetamide
SMILESCCn1nc(-c2cccc(CC(=O)NCCN(C)C)c2)ccc1=O
InChIInChI=1S/C18H24N4O2/c1-4-22-18(24)9-8-16(20-22)15-7-5-6-14(12-15)13-17(23)19-10-11-21(2)3/h5-9,12H,4,10-11,13H2,1-3H3,(H,19,23)
InChIKeyJYISWUDHRSXAOC-UHFFFAOYSA-N
MW328.42 g/mol
LogP1.15
Rot. Bonds7

About N-[2-(dimethylamino)ethyl]-2-[3-(1-ethyl-6-oxopyridazin-3-yl)phenyl]acetamide

N-[2-(dimethylamino)ethyl]-2-[3-(1-ethyl-6-oxopyridazin-3-yl)phenyl]acetamide (PubChem CID 71248336) has the molecular formula C18H24N4O2 and a molecular weight of 328.42 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-2-[3-(1-ethyl-6-oxopyridazin-3-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-2-[3-(1-ethyl-6-oxopyridazin-3-yl)phenyl]acetamide
PubChem CID71248336
Molecular FormulaC18H24N4O2
Molecular Weight328.42 g/mol
Exact Mass328.19
IUPAC NameN-[2-(dimethylamino)ethyl]-2-[3-(1-ethyl-6-oxopyridazin-3-yl)phenyl]acetamide
SMILESCCn1nc(-c2cccc(CC(=O)NCCN(C)C)c2)ccc1=O
InChIInChI=1S/C18H24N4O2/c1-4-22-18(24)9-8-16(20-22)15-7-5-6-14(12-15)13-17(23)19-10-11-21(2)3/h5-9,12H,4,10-11,13H2,1-3H3,(H,19,23)
InChIKeyJYISWUDHRSXAOC-UHFFFAOYSA-N
XLogP1.15
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-2-[3-(1-ethyl-6-oxopyridazin-3-yl)phenyl]acetamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-2-[3-(1-ethyl-6-oxopyridazin-3-yl)phenyl]acetamide (CID 71248336) is N-[2-(dimethylamino)ethyl]-2-[3-(1-ethyl-6-oxopyridazin-3-yl)phenyl]acetamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-2-[3-(1-ethyl-6-oxopyridazin-3-yl)phenyl]acetamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-2-[3-(1-ethyl-6-oxopyridazin-3-yl)phenyl]acetamide is CCn1nc(-c2cccc(CC(=O)NCCN(C)C)c2)ccc1=O.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-2-[3-(1-ethyl-6-oxopyridazin-3-yl)phenyl]acetamide?
The InChIKey is JYISWUDHRSXAOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O2/c1-4-22-18(24)9-8-16(20-22)15-7-5-6-14(12-15)13-17(23)19-10-11-21(2)3/h5-9,12H,4,10-11,13H2,1-3H3,(H,19,23).
What are the key properties of N-[2-(dimethylamino)ethyl]-2-[3-(1-ethyl-6-oxopyridazin-3-yl)phenyl]acetamide?
N-[2-(dimethylamino)ethyl]-2-[3-(1-ethyl-6-oxopyridazin-3-yl)phenyl]acetamide has a molecular weight of 328.42 g/mol, XLogP of 1.15, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-2-[3-(1-ethyl-6-oxopyridazin-3-yl)phenyl]acetamide is sourced from PubChem (CID 71248336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).