N,N-dimethyl-3-[4-(2-methylpropylamino)-6-oxopyridazin-1-yl]propanamide

C13H22N4O2 — CID 103221710

IUPACN,N-dimethyl-3-[4-(2-methylpropylamino)-6-oxopyridazin-1-yl]propanamide
SMILESCC(C)CNc1cnn(CCC(=O)N(C)C)c(=O)c1
InChIInChI=1S/C13H22N4O2/c1-10(2)8-14-11-7-13(19)17(15-9-11)6-5-12(18)16(3)4/h7,9-10,14H,5-6,8H2,1-4H3
InChIKeyUNRMSRZLUCKNCK-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.79
Rot. Bonds6

About N,N-dimethyl-3-[4-(2-methylpropylamino)-6-oxopyridazin-1-yl]propanamide

N,N-dimethyl-3-[4-(2-methylpropylamino)-6-oxopyridazin-1-yl]propanamide (PubChem CID 103221710) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is N,N-dimethyl-3-[4-(2-methylpropylamino)-6-oxopyridazin-1-yl]propanamide.

Molecular Properties

Compound NameN,N-dimethyl-3-[4-(2-methylpropylamino)-6-oxopyridazin-1-yl]propanamide
PubChem CID103221710
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC NameN,N-dimethyl-3-[4-(2-methylpropylamino)-6-oxopyridazin-1-yl]propanamide
SMILESCC(C)CNc1cnn(CCC(=O)N(C)C)c(=O)c1
InChIInChI=1S/C13H22N4O2/c1-10(2)8-14-11-7-13(19)17(15-9-11)6-5-12(18)16(3)4/h7,9-10,14H,5-6,8H2,1-4H3
InChIKeyUNRMSRZLUCKNCK-UHFFFAOYSA-N
XLogP0.79
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N,N-dimethyl-3-[4-(2-methylpropylamino)-6-oxopyridazin-1-yl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-[4-(2-methylpropylamino)-6-oxopyridazin-1-yl]propanamide?
The IUPAC name of N,N-dimethyl-3-[4-(2-methylpropylamino)-6-oxopyridazin-1-yl]propanamide (CID 103221710) is N,N-dimethyl-3-[4-(2-methylpropylamino)-6-oxopyridazin-1-yl]propanamide.
What is the SMILES notation for N,N-dimethyl-3-[4-(2-methylpropylamino)-6-oxopyridazin-1-yl]propanamide?
The canonical SMILES for N,N-dimethyl-3-[4-(2-methylpropylamino)-6-oxopyridazin-1-yl]propanamide is CC(C)CNc1cnn(CCC(=O)N(C)C)c(=O)c1.
What is the InChIKey of N,N-dimethyl-3-[4-(2-methylpropylamino)-6-oxopyridazin-1-yl]propanamide?
The InChIKey is UNRMSRZLUCKNCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-10(2)8-14-11-7-13(19)17(15-9-11)6-5-12(18)16(3)4/h7,9-10,14H,5-6,8H2,1-4H3.
What are the key properties of N,N-dimethyl-3-[4-(2-methylpropylamino)-6-oxopyridazin-1-yl]propanamide?
N,N-dimethyl-3-[4-(2-methylpropylamino)-6-oxopyridazin-1-yl]propanamide has a molecular weight of 266.34 g/mol, XLogP of 0.79, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-[4-(2-methylpropylamino)-6-oxopyridazin-1-yl]propanamide is sourced from PubChem (CID 103221710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).