3-methyl-N-[5-[2-methyl-5-(1,2-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]pyridazine-4-carboxamide

C19H15N5O2S — CID 59014080

IUPAC3-methyl-N-[5-[2-methyl-5-(1,2-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]pyridazine-4-carboxamide
SMILESCc1nnccc1C(=O)Nc1ccc(-c2cc(-c3ccno3)sc2C)cn1
InChIInChI=1S/C19H15N5O2S/c1-11-14(5-7-21-24-11)19(25)23-18-4-3-13(10-20-18)15-9-17(27-12(15)2)16-6-8-22-26-16/h3-10H,1-2H3,(H,20,23,25)
InChIKeyBRGOBBDBCBQQKM-UHFFFAOYSA-N
MW377.43 g/mol
LogP4.12
Rot. Bonds4

About 3-methyl-N-[5-[2-methyl-5-(1,2-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]pyridazine-4-carboxamide

3-methyl-N-[5-[2-methyl-5-(1,2-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]pyridazine-4-carboxamide (PubChem CID 59014080) has the molecular formula C19H15N5O2S and a molecular weight of 377.43 g/mol. Its IUPAC name is 3-methyl-N-[5-[2-methyl-5-(1,2-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]pyridazine-4-carboxamide.

Molecular Properties

Compound Name3-methyl-N-[5-[2-methyl-5-(1,2-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]pyridazine-4-carboxamide
PubChem CID59014080
Molecular FormulaC19H15N5O2S
Molecular Weight377.43 g/mol
Exact Mass377.09
IUPAC Name3-methyl-N-[5-[2-methyl-5-(1,2-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]pyridazine-4-carboxamide
SMILESCc1nnccc1C(=O)Nc1ccc(-c2cc(-c3ccno3)sc2C)cn1
InChIInChI=1S/C19H15N5O2S/c1-11-14(5-7-21-24-11)19(25)23-18-4-3-13(10-20-18)15-9-17(27-12(15)2)16-6-8-22-26-16/h3-10H,1-2H3,(H,20,23,25)
InChIKeyBRGOBBDBCBQQKM-UHFFFAOYSA-N
XLogP4.12
TPSA93.80 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.43
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 3-methyl-N-[5-[2-methyl-5-(1,2-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]pyridazine-4-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

2-fluoro-6-methyl-N-[5-[2-methyl-5-(1,2-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]benzamide
CID 24876400
5-[2-methyl-5-(1,2-oxazol-5-yl)thiophen-3-yl]pyridine-2-carboxamide
CID 69286242
3-methyl-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]pyridine-4-carboxamide
CID 25177362
4-methyl-N-[5-[2-methyl-5-(1,2-oxazol-5-yl)phenyl]pyrazin-2-yl]thiadiazole-5-carboxamide
CID 58683963
N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-5-methyl-1,2-oxazole-4-carboxamide
CID 71526421
3-fluoro-N-[5-(7-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-pyridinyl]pyridine-4-carboxamide
CID 58487162
3-methyl-N-[5-[3-methyl-5-(1,3-oxazol-2-yl)thiophen-2-yl]-2-pyridinyl]pyridine-4-carboxamide
CID 24876060
N-[5-(2,2-difluoro-6-methyl-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,4-dimethyl-3H-pyrrole-5-carboxamide
CID 90394551
N-[5-(3,5-dimethyl-1,2-benzoxazol-6-yl)-2-pyridinyl]-2-fluorobenzamide
CID 58486870
5-[2-methyl-5-(1,2-oxazol-5-yl)phenyl]pyridin-2-amine
CID 59004562
4-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1,3-dimethylpyrazole-5-carboxamide
CID 71526417
N-(5-chloro-2-pyridinyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide
CID 17022037

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[5-[2-methyl-5-(1,2-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]pyridazine-4-carboxamide?
The IUPAC name of 3-methyl-N-[5-[2-methyl-5-(1,2-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]pyridazine-4-carboxamide (CID 59014080) is 3-methyl-N-[5-[2-methyl-5-(1,2-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]pyridazine-4-carboxamide.
What is the SMILES notation for 3-methyl-N-[5-[2-methyl-5-(1,2-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]pyridazine-4-carboxamide?
The canonical SMILES for 3-methyl-N-[5-[2-methyl-5-(1,2-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]pyridazine-4-carboxamide is Cc1nnccc1C(=O)Nc1ccc(-c2cc(-c3ccno3)sc2C)cn1.
What is the InChIKey of 3-methyl-N-[5-[2-methyl-5-(1,2-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]pyridazine-4-carboxamide?
The InChIKey is BRGOBBDBCBQQKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N5O2S/c1-11-14(5-7-21-24-11)19(25)23-18-4-3-13(10-20-18)15-9-17(27-12(15)2)16-6-8-22-26-16/h3-10H,1-2H3,(H,20,23,25).
What are the key properties of 3-methyl-N-[5-[2-methyl-5-(1,2-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]pyridazine-4-carboxamide?
3-methyl-N-[5-[2-methyl-5-(1,2-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]pyridazine-4-carboxamide has a molecular weight of 377.43 g/mol, XLogP of 4.12, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[5-[2-methyl-5-(1,2-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]pyridazine-4-carboxamide is sourced from PubChem (CID 59014080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).