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

C16H22N4O2 — CID 15994478

IUPACN-[2-(dimethylamino)ethyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide
SMILESCN(C)CCNC(=O)CN1N=C(c2ccccc2)CCC1=O
InChIInChI=1S/C16H22N4O2/c1-19(2)11-10-17-15(21)12-20-16(22)9-8-14(18-20)13-6-4-3-5-7-13/h3-7H,8-12H2,1-2H3,(H,17,21)
InChIKeyQADVSTHOIIGZAY-UHFFFAOYSA-N
MW302.38 g/mol
LogP0.69
Rot. Bonds6

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

N-[2-(dimethylamino)ethyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide (PubChem CID 15994478) has the molecular formula C16H22N4O2 and a molecular weight of 302.38 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide
PubChem CID15994478
Molecular FormulaC16H22N4O2
Molecular Weight302.38 g/mol
Exact Mass302.17
IUPAC NameN-[2-(dimethylamino)ethyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide
SMILESCN(C)CCNC(=O)CN1N=C(c2ccccc2)CCC1=O
InChIInChI=1S/C16H22N4O2/c1-19(2)11-10-17-15(21)12-20-16(22)9-8-14(18-20)13-6-4-3-5-7-13/h3-7H,8-12H2,1-2H3,(H,17,21)
InChIKeyQADVSTHOIIGZAY-UHFFFAOYSA-N
XLogP0.69
TPSA65.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-Ethyl-6-phenyl-4,5-dihydro-2H-pyridazin-3-one
CID 814967
2-(3-butyl-4-oxo-3,4-dihydrophthalazin-1-yl)-N-(2-(diethylamino)ethyl)acetamide
CID 1827716
N-butyl-2-[3-(4-methylphenyl)-6-oxopyridazin-1(6H)-yl]acetamide
CID 5099386
N-[2-oxo-2-[(2E)-2-(1-phenylpropan-2-ylidene)hydrazinyl]ethyl]-2-phenylacetamide
CID 5900961
N-[2-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-2-oxoethyl]-3-phenylpropanamide
CID 5904279
N-cyclopentyl-3-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)propanamide
CID 6624453
N-butyl-3-(6-oxo-3-phenyl-5,6-dihydropyridazin-1(4H)-yl)propanamide
CID 15992445
2-[3-(4-chlorophenyl)-6-oxo-5,6-dihydropyridazin-1(4H)-yl]-N-(3-methylbutyl)acetamide
CID 16034816
N-benzyl-2-(6-oxo-3-phenyl-5,6-dihydropyridazin-1(4H)-yl)acetamide
CID 16189572
Acetamide, N-[3-(3-dimethylaminopropylamino)propyl]-2-hydroxyimino-2-phenyl-
CID 6407080
2-(4-benzyl-1-oxo-2(1H)-phthalazinyl)-N-[2-(diethylamino)ethyl]acetamide
CID 2288386
N-[3-(4-methylpiperazin-1-yl)propyl]-2-(6-oxo-3-phenylpyridazin-1(6H)-yl)acetamide
CID 3235823

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide (CID 15994478) is N-[2-(dimethylamino)ethyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide is CN(C)CCNC(=O)CN1N=C(c2ccccc2)CCC1=O.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide?
The InChIKey is QADVSTHOIIGZAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O2/c1-19(2)11-10-17-15(21)12-20-16(22)9-8-14(18-20)13-6-4-3-5-7-13/h3-7H,8-12H2,1-2H3,(H,17,21).
What are the key properties of N-[2-(dimethylamino)ethyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide?
N-[2-(dimethylamino)ethyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide has a molecular weight of 302.38 g/mol, XLogP of 0.69, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-2-(6-oxo-3-phenyl-4,5-dihydropyridazin-1-yl)acetamide is sourced from PubChem (CID 15994478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).