N-methyl-6-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]pyridazine-3-carboxamide

C17H19N7OS — CID 133487033

IUPACN-methyl-6-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]pyridazine-3-carboxamide
SMILESCNC(=O)c1ccc(N2CCN(c3ncnc4sc(C)cc34)CC2)nn1
InChIInChI=1S/C17H19N7OS/c1-11-9-12-15(19-10-20-17(12)26-11)24-7-5-23(6-8-24)14-4-3-13(21-22-14)16(25)18-2/h3-4,9-10H,5-8H2,1-2H3,(H,18,25)
InChIKeyAJPKQIHSQSEDJL-UHFFFAOYSA-N
MW369.45 g/mol
LogP1.48
Rot. Bonds3

About N-methyl-6-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]pyridazine-3-carboxamide

N-methyl-6-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]pyridazine-3-carboxamide (PubChem CID 133487033) has the molecular formula C17H19N7OS and a molecular weight of 369.45 g/mol. Its IUPAC name is N-methyl-6-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-6-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]pyridazine-3-carboxamide
PubChem CID133487033
Molecular FormulaC17H19N7OS
Molecular Weight369.45 g/mol
Exact Mass369.14
IUPAC NameN-methyl-6-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]pyridazine-3-carboxamide
SMILESCNC(=O)c1ccc(N2CCN(c3ncnc4sc(C)cc34)CC2)nn1
InChIInChI=1S/C17H19N7OS/c1-11-9-12-15(19-10-20-17(12)26-11)24-7-5-23(6-8-24)14-4-3-13(21-22-14)16(25)18-2/h3-4,9-10H,5-8H2,1-2H3,(H,18,25)
InChIKeyAJPKQIHSQSEDJL-UHFFFAOYSA-N
XLogP1.48
TPSA87.14 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.45
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze N-methyl-6-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]pyridazine-3-carboxamide 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-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]pyridazine-3-carboxamide
CID 133487212
6-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-N-(1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide
CID 133487127
6-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-N-prop-2-ynylpyridine-3-carboxamide
CID 133487281
6-methyl-4-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]thieno[2,3-d]pyrimidine
CID 133408657
2,2-dimethyl-1-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]propan-1-one
CID 39072814
6-methyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine
CID 2229510
1-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]butan-1-one
CID 39072808
N-methyl-6-[4-(2-methylpyrimidin-4-yl)piperazin-1-yl]pyridazine-3-carboxamide
CID 133458571
(2-methylphenyl)-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]methanone
CID 39072836
phenyl 4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxylate
CID 21062807
1-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]pentan-1-one
CID 39072810
6-methyl-4-[4-(2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]thieno[2,3-d]pyrimidine
CID 133487059

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]pyridazine-3-carboxamide?
The IUPAC name of N-methyl-6-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]pyridazine-3-carboxamide (CID 133487033) is N-methyl-6-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]pyridazine-3-carboxamide.
What is the SMILES notation for N-methyl-6-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]pyridazine-3-carboxamide?
The canonical SMILES for N-methyl-6-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]pyridazine-3-carboxamide is CNC(=O)c1ccc(N2CCN(c3ncnc4sc(C)cc34)CC2)nn1.
What is the InChIKey of N-methyl-6-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]pyridazine-3-carboxamide?
The InChIKey is AJPKQIHSQSEDJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N7OS/c1-11-9-12-15(19-10-20-17(12)26-11)24-7-5-23(6-8-24)14-4-3-13(21-22-14)16(25)18-2/h3-4,9-10H,5-8H2,1-2H3,(H,18,25).
What are the key properties of N-methyl-6-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]pyridazine-3-carboxamide?
N-methyl-6-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]pyridazine-3-carboxamide has a molecular weight of 369.45 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-[4-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]pyridazine-3-carboxamide is sourced from PubChem (CID 133487033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).