2-[1-[[[6-(dimethylcarbamoyl)pyridazin-3-yl]amino]methyl]cyclobutyl]acetic acid

C14H20N4O3 — CID 81163939

IUPAC2-[1-[[[6-(dimethylcarbamoyl)pyridazin-3-yl]amino]methyl]cyclobutyl]acetic acid
SMILESCN(C)C(=O)c1ccc(NCC2(CC(=O)O)CCC2)nn1
InChIInChI=1S/C14H20N4O3/c1-18(2)13(21)10-4-5-11(17-16-10)15-9-14(6-3-7-14)8-12(19)20/h4-5H,3,6-9H2,1-2H3,(H,15,17)(H,19,20)
InChIKeyDVDOGTVYFKZIQS-UHFFFAOYSA-N
MW292.34 g/mol
LogP1.24
Rot. Bonds6

About 2-[1-[[[6-(dimethylcarbamoyl)pyridazin-3-yl]amino]methyl]cyclobutyl]acetic acid

2-[1-[[[6-(dimethylcarbamoyl)pyridazin-3-yl]amino]methyl]cyclobutyl]acetic acid (PubChem CID 81163939) has the molecular formula C14H20N4O3 and a molecular weight of 292.34 g/mol. Its IUPAC name is 2-[1-[[[6-(dimethylcarbamoyl)pyridazin-3-yl]amino]methyl]cyclobutyl]acetic acid.

Molecular Properties

Compound Name2-[1-[[[6-(dimethylcarbamoyl)pyridazin-3-yl]amino]methyl]cyclobutyl]acetic acid
PubChem CID81163939
Molecular FormulaC14H20N4O3
Molecular Weight292.34 g/mol
Exact Mass292.15
IUPAC Name2-[1-[[[6-(dimethylcarbamoyl)pyridazin-3-yl]amino]methyl]cyclobutyl]acetic acid
SMILESCN(C)C(=O)c1ccc(NCC2(CC(=O)O)CCC2)nn1
InChIInChI=1S/C14H20N4O3/c1-18(2)13(21)10-4-5-11(17-16-10)15-9-14(6-3-7-14)8-12(19)20/h4-5H,3,6-9H2,1-2H3,(H,15,17)(H,19,20)
InChIKeyDVDOGTVYFKZIQS-UHFFFAOYSA-N
XLogP1.24
TPSA95.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[1-[[[6-(dimethylcarbamoyl)pyridazin-3-yl]amino]methyl]cyclobutyl]acetic acid with MolForge

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

Launch Full Analysis

Related Compounds

6-[(1-ethylcyclobutyl)methylamino]pyridazine-3-carboxamide
CID 103741792
methyl 6-[[1-[(dimethylamino)methyl]cyclopentyl]methylamino]pyridazine-3-carboxylate
CID 133491640
N-ethyl-6-[(1-ethylcyclopentyl)methylamino]pyridazine-3-carboxamide
CID 103764956
6-[2-(carbamoylamino)ethylamino]-N,N-dimethylpyridazine-3-carboxamide
CID 83114171
6-[[1-(aminomethyl)cyclopentyl]methylamino]pyridazine-3-carboxamide
CID 113295252
2-[1-[(dimethylcarbamoylamino)methyl]cyclobutyl]acetic acid
CID 81164855
N,N-dimethyl-6-[(2-methylcyclopentyl)methylamino]pyridazine-3-carboxamide
CID 107419298
2-[1-[[(6-amino-5-nitro-2-pyridinyl)amino]methyl]cyclobutyl]acetic acid
CID 81162036
6-hydrazinyl-N,N-dimethylpyridazine-3-carboxamide
CID 62236767
2-[[6-(dimethylcarbamoyl)pyridazin-3-yl]amino]ethyl carbamate
CID 83203413
6-[(1-propylcyclopropyl)methylamino]pyridazine-3-carboxamide
CID 113256808
N-ethyl-6-[(1-propylcyclopropyl)methylamino]pyridazine-3-carboxamide
CID 103761722

Frequently Asked Questions

What is the IUPAC name of 2-[1-[[[6-(dimethylcarbamoyl)pyridazin-3-yl]amino]methyl]cyclobutyl]acetic acid?
The IUPAC name of 2-[1-[[[6-(dimethylcarbamoyl)pyridazin-3-yl]amino]methyl]cyclobutyl]acetic acid (CID 81163939) is 2-[1-[[[6-(dimethylcarbamoyl)pyridazin-3-yl]amino]methyl]cyclobutyl]acetic acid.
What is the SMILES notation for 2-[1-[[[6-(dimethylcarbamoyl)pyridazin-3-yl]amino]methyl]cyclobutyl]acetic acid?
The canonical SMILES for 2-[1-[[[6-(dimethylcarbamoyl)pyridazin-3-yl]amino]methyl]cyclobutyl]acetic acid is CN(C)C(=O)c1ccc(NCC2(CC(=O)O)CCC2)nn1.
What is the InChIKey of 2-[1-[[[6-(dimethylcarbamoyl)pyridazin-3-yl]amino]methyl]cyclobutyl]acetic acid?
The InChIKey is DVDOGTVYFKZIQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O3/c1-18(2)13(21)10-4-5-11(17-16-10)15-9-14(6-3-7-14)8-12(19)20/h4-5H,3,6-9H2,1-2H3,(H,15,17)(H,19,20).
What are the key properties of 2-[1-[[[6-(dimethylcarbamoyl)pyridazin-3-yl]amino]methyl]cyclobutyl]acetic acid?
2-[1-[[[6-(dimethylcarbamoyl)pyridazin-3-yl]amino]methyl]cyclobutyl]acetic acid has a molecular weight of 292.34 g/mol, XLogP of 1.24, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[[[6-(dimethylcarbamoyl)pyridazin-3-yl]amino]methyl]cyclobutyl]acetic acid is sourced from PubChem (CID 81163939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).