5-chloro-4-[(2-methylpiperidin-4-yl)amino]-1H-pyridazin-6-one

C10H15ClN4O — CID 106996144

IUPAC5-chloro-4-[(2-methylpiperidin-4-yl)amino]-1H-pyridazin-6-one
SMILESCC1CC(Nc2cn[nH]c(=O)c2Cl)CCN1
InChIInChI=1S/C10H15ClN4O/c1-6-4-7(2-3-12-6)14-8-5-13-15-10(16)9(8)11/h5-7,12H,2-4H2,1H3,(H2,14,15,16)
InChIKeyMUEYJDQDQAFWQW-UHFFFAOYSA-N
MW242.71 g/mol
LogP0.98
Rot. Bonds2

About 5-chloro-4-[(2-methylpiperidin-4-yl)amino]-1H-pyridazin-6-one

5-chloro-4-[(2-methylpiperidin-4-yl)amino]-1H-pyridazin-6-one (PubChem CID 106996144) has the molecular formula C10H15ClN4O and a molecular weight of 242.71 g/mol. Its IUPAC name is 5-chloro-4-[(2-methylpiperidin-4-yl)amino]-1H-pyridazin-6-one.

Molecular Properties

Compound Name5-chloro-4-[(2-methylpiperidin-4-yl)amino]-1H-pyridazin-6-one
PubChem CID106996144
Molecular FormulaC10H15ClN4O
Molecular Weight242.71 g/mol
Exact Mass242.09
IUPAC Name5-chloro-4-[(2-methylpiperidin-4-yl)amino]-1H-pyridazin-6-one
SMILESCC1CC(Nc2cn[nH]c(=O)c2Cl)CCN1
InChIInChI=1S/C10H15ClN4O/c1-6-4-7(2-3-12-6)14-8-5-13-15-10(16)9(8)11/h5-7,12H,2-4H2,1H3,(H2,14,15,16)
InChIKeyMUEYJDQDQAFWQW-UHFFFAOYSA-N
XLogP0.98
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.71
LogP ≤ 50.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 5-chloro-4-[(2-methylpiperidin-4-yl)amino]-1H-pyridazin-6-one 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

5-chloro-4-(cyclobutylamino)-1H-pyridazin-6-one
CID 78950467
5-chloro-4-[(4-hydroxycyclohexyl)amino]-1H-pyridazin-6-one
CID 78913346
5-chloro-4-[(2-cyclopropyloxan-4-yl)amino]-1H-pyridazin-6-one
CID 133473763
5-chloro-4-[[4-(hydroxymethyl)cyclohexyl]amino]-1H-pyridazin-6-one
CID 112753380
5-chloro-4-[(1-methyl-6-oxopiperidin-3-yl)amino]-1H-pyridazin-6-one
CID 78997179
4-chloro-2-(2-methoxyethyl)-5-[(2-methylpiperidin-4-yl)amino]pyridazin-3-one
CID 106995934
5-chloro-4-[[1-(2-methylpropyl)piperidin-4-yl]amino]-1H-pyridazin-6-one
CID 134038847
methyl 2-[5-chloro-4-[(2-methylpiperidin-4-yl)amino]-6-oxopyridazin-1-yl]acetate
CID 106995982
5-chloro-4-[(1,3-dimethylpiperidin-4-yl)amino]-1H-pyridazin-6-one
CID 114504898
5-chloro-4-(7-oxabicyclo[2.2.1]heptan-2-ylamino)-1H-pyridazin-6-one
CID 75539652
5-chloro-4-[[(3S)-1-phenylpyrrolidin-3-yl]amino]-1H-pyridazin-6-one
CID 97209139
3-methyl-N-(2-methylpiperidin-4-yl)pyridin-4-amine
CID 106995966

Frequently Asked Questions

What is the IUPAC name of 5-chloro-4-[(2-methylpiperidin-4-yl)amino]-1H-pyridazin-6-one?
The IUPAC name of 5-chloro-4-[(2-methylpiperidin-4-yl)amino]-1H-pyridazin-6-one (CID 106996144) is 5-chloro-4-[(2-methylpiperidin-4-yl)amino]-1H-pyridazin-6-one.
What is the SMILES notation for 5-chloro-4-[(2-methylpiperidin-4-yl)amino]-1H-pyridazin-6-one?
The canonical SMILES for 5-chloro-4-[(2-methylpiperidin-4-yl)amino]-1H-pyridazin-6-one is CC1CC(Nc2cn[nH]c(=O)c2Cl)CCN1.
What is the InChIKey of 5-chloro-4-[(2-methylpiperidin-4-yl)amino]-1H-pyridazin-6-one?
The InChIKey is MUEYJDQDQAFWQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN4O/c1-6-4-7(2-3-12-6)14-8-5-13-15-10(16)9(8)11/h5-7,12H,2-4H2,1H3,(H2,14,15,16).
What are the key properties of 5-chloro-4-[(2-methylpiperidin-4-yl)amino]-1H-pyridazin-6-one?
5-chloro-4-[(2-methylpiperidin-4-yl)amino]-1H-pyridazin-6-one has a molecular weight of 242.71 g/mol, XLogP of 0.98, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-4-[(2-methylpiperidin-4-yl)amino]-1H-pyridazin-6-one is sourced from PubChem (CID 106996144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).