N-[(3R)-1-ethylpiperidin-3-yl]-1-methylpyrazolo[3,4-d]pyridazin-7-amine

C13H20N6 — CID 171783143

IUPACN-[(3R)-1-ethylpiperidin-3-yl]-1-methylpyrazolo[3,4-d]pyridazin-7-amine
SMILESCCN1CCC[C@@H](Nc2nncc3cnn(C)c23)C1
InChIInChI=1S/C13H20N6/c1-3-19-6-4-5-11(9-19)16-13-12-10(7-14-17-13)8-15-18(12)2/h7-8,11H,3-6,9H2,1-2H3,(H,16,17)/t11-/m1/s1
InChIKeyHSZSQDFNMMQLJN-LLVKDONJSA-N
MW260.34 g/mol
LogP1.26
Rot. Bonds3

About N-[(3R)-1-ethylpiperidin-3-yl]-1-methylpyrazolo[3,4-d]pyridazin-7-amine

N-[(3R)-1-ethylpiperidin-3-yl]-1-methylpyrazolo[3,4-d]pyridazin-7-amine (PubChem CID 171783143) has the molecular formula C13H20N6 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-[(3R)-1-ethylpiperidin-3-yl]-1-methylpyrazolo[3,4-d]pyridazin-7-amine.

Molecular Properties

Compound NameN-[(3R)-1-ethylpiperidin-3-yl]-1-methylpyrazolo[3,4-d]pyridazin-7-amine
PubChem CID171783143
Molecular FormulaC13H20N6
Molecular Weight260.34 g/mol
Exact Mass260.17
IUPAC NameN-[(3R)-1-ethylpiperidin-3-yl]-1-methylpyrazolo[3,4-d]pyridazin-7-amine
SMILESCCN1CCC[C@@H](Nc2nncc3cnn(C)c23)C1
InChIInChI=1S/C13H20N6/c1-3-19-6-4-5-11(9-19)16-13-12-10(7-14-17-13)8-15-18(12)2/h7-8,11H,3-6,9H2,1-2H3,(H,16,17)/t11-/m1/s1
InChIKeyHSZSQDFNMMQLJN-LLVKDONJSA-N
XLogP1.26
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[(3R)-1-ethylpiperidin-3-yl]-1-methylpyrazolo[3,4-d]pyridazin-7-amine 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

N-[(3R)-1-ethylpiperidin-3-yl]-3-methyl-[1,2]oxazolo[4,5-d]pyridazin-4-amine
CID 171783137
5-chloro-4-N-(1-ethylpiperidin-3-yl)pyrimidine-2,4-diamine
CID 80800762
N-(1-ethylpiperidin-3-yl)-2-hydrazinyl-5-methylpyrimidin-4-amine
CID 80897250
3,5-dibromo-N-(1-ethylpiperidin-3-yl)pyridin-2-amine
CID 113413667
3-N-(1-ethylpiperidin-3-yl)-1-methylpyrazole-3,4-diamine
CID 103078216
N-(1-ethylpiperidin-3-yl)-5,6-dimethylpyrazin-2-amine
CID 114475474
3,5-dichloro-2-N-ethyl-6-N-(1-ethylpiperidin-3-yl)pyridine-2,6-diamine
CID 102756946
2-N-(1-ethylpiperidin-3-yl)-6-methoxypyridine-2,3-diamine
CID 113286474
1-ethyl-N-(1-methylimidazol-2-yl)piperidin-3-amine
CID 62133127
4-N-(1-ethylpiperidin-3-yl)-2-N,6-dimethylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103326015
4-chloro-N-(1-ethylpiperidin-3-yl)phthalazin-1-amine
CID 62142127
1-chloro-N-[(3R)-1-ethylpiperidin-3-yl]pyrido[3,4-d]pyridazin-4-amine
CID 171830814

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-1-ethylpiperidin-3-yl]-1-methylpyrazolo[3,4-d]pyridazin-7-amine?
The IUPAC name of N-[(3R)-1-ethylpiperidin-3-yl]-1-methylpyrazolo[3,4-d]pyridazin-7-amine (CID 171783143) is N-[(3R)-1-ethylpiperidin-3-yl]-1-methylpyrazolo[3,4-d]pyridazin-7-amine.
What is the SMILES notation for N-[(3R)-1-ethylpiperidin-3-yl]-1-methylpyrazolo[3,4-d]pyridazin-7-amine?
The canonical SMILES for N-[(3R)-1-ethylpiperidin-3-yl]-1-methylpyrazolo[3,4-d]pyridazin-7-amine is CCN1CCC[C@@H](Nc2nncc3cnn(C)c23)C1.
What is the InChIKey of N-[(3R)-1-ethylpiperidin-3-yl]-1-methylpyrazolo[3,4-d]pyridazin-7-amine?
The InChIKey is HSZSQDFNMMQLJN-LLVKDONJSA-N. The full InChI is InChI=1S/C13H20N6/c1-3-19-6-4-5-11(9-19)16-13-12-10(7-14-17-13)8-15-18(12)2/h7-8,11H,3-6,9H2,1-2H3,(H,16,17)/t11-/m1/s1.
What are the key properties of N-[(3R)-1-ethylpiperidin-3-yl]-1-methylpyrazolo[3,4-d]pyridazin-7-amine?
N-[(3R)-1-ethylpiperidin-3-yl]-1-methylpyrazolo[3,4-d]pyridazin-7-amine has a molecular weight of 260.34 g/mol, XLogP of 1.26, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-1-ethylpiperidin-3-yl]-1-methylpyrazolo[3,4-d]pyridazin-7-amine is sourced from PubChem (CID 171783143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).