N-[2-(diethylamino)ethyl]-3-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)propanamide

C19H28N4O2 — CID 24762061

IUPACN-[2-(diethylamino)ethyl]-3-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)propanamide
SMILESCCN(CC)CCNC(=O)CCN1N=C(c2ccccc2)CCC1=O
InChIInChI=1S/C19H28N4O2/c1-3-22(4-2)15-13-20-18(24)12-14-23-19(25)11-10-17(21-23)16-8-6-5-7-9-16/h5-9H,3-4,10-15H2,1-2H3,(H,20,24)
InChIKeyNKEJZWDEJPBWPS-UHFFFAOYSA-N
MW344.46 g/mol
LogP1.86
Rot. Bonds9

About N-[2-(diethylamino)ethyl]-3-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)propanamide

N-[2-(diethylamino)ethyl]-3-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)propanamide (PubChem CID 24762061) has the molecular formula C19H28N4O2 and a molecular weight of 344.46 g/mol. Its IUPAC name is N-[2-(diethylamino)ethyl]-3-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)propanamide.

Molecular Properties

Compound NameN-[2-(diethylamino)ethyl]-3-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)propanamide
PubChem CID24762061
Molecular FormulaC19H28N4O2
Molecular Weight344.46 g/mol
Exact Mass344.22
IUPAC NameN-[2-(diethylamino)ethyl]-3-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)propanamide
SMILESCCN(CC)CCNC(=O)CCN1N=C(c2ccccc2)CCC1=O
InChIInChI=1S/C19H28N4O2/c1-3-22(4-2)15-13-20-18(24)12-14-23-19(25)11-10-17(21-23)16-8-6-5-7-9-16/h5-9H,3-4,10-15H2,1-2H3,(H,20,24)
InChIKeyNKEJZWDEJPBWPS-UHFFFAOYSA-N
XLogP1.86
TPSA65.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)ethyl]-3-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)propanamide?
The IUPAC name of N-[2-(diethylamino)ethyl]-3-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)propanamide (CID 24762061) is N-[2-(diethylamino)ethyl]-3-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)propanamide.
What is the SMILES notation for N-[2-(diethylamino)ethyl]-3-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)propanamide?
The canonical SMILES for N-[2-(diethylamino)ethyl]-3-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)propanamide is CCN(CC)CCNC(=O)CCN1N=C(c2ccccc2)CCC1=O.
What is the InChIKey of N-[2-(diethylamino)ethyl]-3-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)propanamide?
The InChIKey is NKEJZWDEJPBWPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N4O2/c1-3-22(4-2)15-13-20-18(24)12-14-23-19(25)11-10-17(21-23)16-8-6-5-7-9-16/h5-9H,3-4,10-15H2,1-2H3,(H,20,24).
What are the key properties of N-[2-(diethylamino)ethyl]-3-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)propanamide?
N-[2-(diethylamino)ethyl]-3-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)propanamide has a molecular weight of 344.46 g/mol, XLogP of 1.86, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)ethyl]-3-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)propanamide is sourced from PubChem (CID 24762061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).