6-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyridazine-3-carboxamide

C11H13N5OS — CID 79099798

IUPAC6-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyridazine-3-carboxamide
SMILESCc1csc(C(C)Nc2ccc(C(N)=O)nn2)n1
InChIInChI=1S/C11H13N5OS/c1-6-5-18-11(13-6)7(2)14-9-4-3-8(10(12)17)15-16-9/h3-5,7H,1-2H3,(H2,12,17)(H,14,16)
InChIKeyRMWOBRXFQRXSSN-UHFFFAOYSA-N
MW263.33 g/mol
LogP1.51
Rot. Bonds4

About 6-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyridazine-3-carboxamide

6-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyridazine-3-carboxamide (PubChem CID 79099798) has the molecular formula C11H13N5OS and a molecular weight of 263.33 g/mol. Its IUPAC name is 6-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyridazine-3-carboxamide
PubChem CID79099798
Molecular FormulaC11H13N5OS
Molecular Weight263.33 g/mol
Exact Mass263.08
IUPAC Name6-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyridazine-3-carboxamide
SMILESCc1csc(C(C)Nc2ccc(C(N)=O)nn2)n1
InChIInChI=1S/C11H13N5OS/c1-6-5-18-11(13-6)7(2)14-9-4-3-8(10(12)17)15-16-9/h3-5,7H,1-2H3,(H2,12,17)(H,14,16)
InChIKeyRMWOBRXFQRXSSN-UHFFFAOYSA-N
XLogP1.51
TPSA93.79 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.33
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

methyl 6-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyrazine-2-carboxylate
CID 66455747
methyl 5-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyrazine-2-carboxylate
CID 114059816
1-[2-amino-4-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]phenyl]ethanone
CID 104528908
N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]quinolin-2-amine
CID 63090359
2-methyl-6-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyridine-4-carbothioamide
CID 114767732
2,3-difluoro-4-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]benzenecarbothioamide
CID 107935034
2-hydrazinyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine
CID 80917622
2-fluoro-4-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]benzoic acid
CID 113319865
2-amino-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]propanamide;dihydrochloride
CID 119875872
6-[1-(3-bromophenyl)ethylamino]pyridazine-3-carboxamide
CID 79099168
2-methyl-3-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]-3-oxopropanoic acid
CID 114898569
6-hydrazinyl-N-(4-methyl-1,3-thiazol-2-yl)pyridazine-3-carboxamide
CID 62237852

Frequently Asked Questions

What is the IUPAC name of 6-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyridazine-3-carboxamide?
The IUPAC name of 6-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyridazine-3-carboxamide (CID 79099798) is 6-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyridazine-3-carboxamide.
What is the SMILES notation for 6-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyridazine-3-carboxamide?
The canonical SMILES for 6-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyridazine-3-carboxamide is Cc1csc(C(C)Nc2ccc(C(N)=O)nn2)n1.
What is the InChIKey of 6-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyridazine-3-carboxamide?
The InChIKey is RMWOBRXFQRXSSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5OS/c1-6-5-18-11(13-6)7(2)14-9-4-3-8(10(12)17)15-16-9/h3-5,7H,1-2H3,(H2,12,17)(H,14,16).
What are the key properties of 6-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyridazine-3-carboxamide?
6-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyridazine-3-carboxamide has a molecular weight of 263.33 g/mol, XLogP of 1.51, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyridazine-3-carboxamide is sourced from PubChem (CID 79099798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).