N,N-dimethyl-3-[(6-oxo-1H-pyridazin-3-yl)amino]propanamide

C9H14N4O2 — CID 155801723

IUPACN,N-dimethyl-3-[(6-oxo-1H-pyridazin-3-yl)amino]propanamide
SMILESCN(C)C(=O)CCNc1ccc(=O)[nH]n1
InChIInChI=1S/C9H14N4O2/c1-13(2)9(15)5-6-10-7-3-4-8(14)12-11-7/h3-4H,5-6H2,1-2H3,(H,10,11)(H,12,14)
InChIKeyWWTMEGVONAHFNH-UHFFFAOYSA-N
MW210.24 g/mol
LogP-0.34
Rot. Bonds4

About N,N-dimethyl-3-[(6-oxo-1H-pyridazin-3-yl)amino]propanamide

N,N-dimethyl-3-[(6-oxo-1H-pyridazin-3-yl)amino]propanamide (PubChem CID 155801723) has the molecular formula C9H14N4O2 and a molecular weight of 210.24 g/mol. Its IUPAC name is N,N-dimethyl-3-[(6-oxo-1H-pyridazin-3-yl)amino]propanamide.

Molecular Properties

Compound NameN,N-dimethyl-3-[(6-oxo-1H-pyridazin-3-yl)amino]propanamide
PubChem CID155801723
Molecular FormulaC9H14N4O2
Molecular Weight210.24 g/mol
Exact Mass210.11
IUPAC NameN,N-dimethyl-3-[(6-oxo-1H-pyridazin-3-yl)amino]propanamide
SMILESCN(C)C(=O)CCNc1ccc(=O)[nH]n1
InChIInChI=1S/C9H14N4O2/c1-13(2)9(15)5-6-10-7-3-4-8(14)12-11-7/h3-4H,5-6H2,1-2H3,(H,10,11)(H,12,14)
InChIKeyWWTMEGVONAHFNH-UHFFFAOYSA-N
XLogP-0.34
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 5-0.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-(Ethylamino)pyridazin-3(2H)-one
CID 13274962
6-(Propylamino)pyridazin-3(2H)-one
CID 13274963
6-(Butylamino)pyridazin-3(2H)-one
CID 13274966
N-[2-(methylamino)ethyl]-N-(2-oxopropyl)-3-[(6-oxo-1H-pyridazin-3-yl)amino]propanamide
CID 20793803
6-(Diethylamino)pyridazin-3(2H)-one
CID 70522275
N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-[(6-oxo-1H-pyridazin-3-yl)amino]-N-[2-(propan-2-ylamino)ethyl]propanamide
CID 90292314
N-[2-(methylamino)ethyl]-N-[2-(methylamino)-2-oxoethyl]-3-[(6-oxo-1H-pyridazin-3-yl)amino]propanamide
CID 90292867
6-(Isobutylamino)pyridazin-3-ol
CID 121205006
6-(Butyl(ethyl)amino)pyridazin-3-ol
CID 121205017
3-(2,2-dimethylpropylamino)-1H-pyridazin-6-one
CID 126992242
N-methyl-3-(methylamino)-6-oxo-1H-pyridazine-4-carboxamide
CID 137400053
N,N-dimethyl-3-(methylamino)-6-oxo-1H-pyridazine-4-carboxamide
CID 137400067

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-[(6-oxo-1H-pyridazin-3-yl)amino]propanamide?
The IUPAC name of N,N-dimethyl-3-[(6-oxo-1H-pyridazin-3-yl)amino]propanamide (CID 155801723) is N,N-dimethyl-3-[(6-oxo-1H-pyridazin-3-yl)amino]propanamide.
What is the SMILES notation for N,N-dimethyl-3-[(6-oxo-1H-pyridazin-3-yl)amino]propanamide?
The canonical SMILES for N,N-dimethyl-3-[(6-oxo-1H-pyridazin-3-yl)amino]propanamide is CN(C)C(=O)CCNc1ccc(=O)[nH]n1.
What is the InChIKey of N,N-dimethyl-3-[(6-oxo-1H-pyridazin-3-yl)amino]propanamide?
The InChIKey is WWTMEGVONAHFNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2/c1-13(2)9(15)5-6-10-7-3-4-8(14)12-11-7/h3-4H,5-6H2,1-2H3,(H,10,11)(H,12,14).
What are the key properties of N,N-dimethyl-3-[(6-oxo-1H-pyridazin-3-yl)amino]propanamide?
N,N-dimethyl-3-[(6-oxo-1H-pyridazin-3-yl)amino]propanamide has a molecular weight of 210.24 g/mol, XLogP of -0.34, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-[(6-oxo-1H-pyridazin-3-yl)amino]propanamide is sourced from PubChem (CID 155801723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).