3-amino-4,5,6-trimethyl-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]pyridine-2-carboxamide

C15H16N4O2S — CID 948055

IUPAC3-amino-4,5,6-trimethyl-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]pyridine-2-carboxamide
SMILESCc1cc(NC(=O)c2sc3nc(C)c(C)c(C)c3c2N)no1
InChIInChI=1S/C15H16N4O2S/c1-6-5-10(19-21-6)18-14(20)13-12(16)11-8(3)7(2)9(4)17-15(11)22-13/h5H,16H2,1-4H3,(H,18,19,20)
InChIKeyJONHPUKYDLPXRF-UHFFFAOYSA-N
MW316.39 g/mol
LogP3.35
Rot. Bonds2

About 3-amino-4,5,6-trimethyl-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]pyridine-2-carboxamide

3-amino-4,5,6-trimethyl-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]pyridine-2-carboxamide (PubChem CID 948055) has the molecular formula C15H16N4O2S and a molecular weight of 316.39 g/mol. Its IUPAC name is 3-amino-4,5,6-trimethyl-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-4,5,6-trimethyl-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]pyridine-2-carboxamide
PubChem CID948055
Molecular FormulaC15H16N4O2S
Molecular Weight316.39 g/mol
Exact Mass316.10
IUPAC Name3-amino-4,5,6-trimethyl-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]pyridine-2-carboxamide
SMILESCc1cc(NC(=O)c2sc3nc(C)c(C)c(C)c3c2N)no1
InChIInChI=1S/C15H16N4O2S/c1-6-5-10(19-21-6)18-14(20)13-12(16)11-8(3)7(2)9(4)17-15(11)22-13/h5H,16H2,1-4H3,(H,18,19,20)
InChIKeyJONHPUKYDLPXRF-UHFFFAOYSA-N
XLogP3.35
TPSA94.04 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.39
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-amino-4-(4-methoxyphenyl)-N-(5-methyl-3-isoxazolyl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide
CID 1201903
3-amino-6-methyl-N-(5-methyl-1,2-oxazol-3-yl)-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide
CID 647187
N-(5-methyl-1,2-oxazol-3-yl)-2-(5-methylthiophen-2-yl)quinoline-4-carboxamide
CID 2059829
2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-1,3-benzothiazole-6-carboxamide
CID 2319352
N-(5-methyl-1,2-oxazol-3-yl)-2-[(2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide
CID 2612492
2,5-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-4-(N-methyl-4-propan-2-ylanilino)thieno[2,3-d]pyrimidine-6-carboxamide
CID 23734246
3-amino-N-(5-methyl-1,2-oxazol-3-yl)-6-phenyl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide
CID 1086352
3-amino-4-(difluoromethyl)-6-methyl-N-(5-methylisoxazol-3-yl)thieno[2,3-b]pyridine-2-carboxamide
CID 47001015
3-amino-6-methyl-N-(5-methyl-3-isoxazolyl)-4-(2-thienyl)-5,6,7,8-tetrahydrothieno[2,3-b]-1,6-naphthyridine-2-carboxamide
CID 2057298
7-amino-N-(5-methyl-1,2-oxazol-3-yl)-5-thia-1,3-diazatetracyclo[9.2.2.02,10.04,8]pentadeca-2(10),3,6,8-tetraene-6-carboxamide
CID 2990596
6-acetyl-3-amino-N-(5-methyl-3-isoxazolyl)-4-(trifluoromethyl)-5,6,7,8-tetrahydrothieno[2,3-b][1,6]naphthyridine-2-carboxamide
CID 1508922
Thieno[2,3-b]pyridine-2-carboxamide, 3-amino-6-(pyridin-3-yl)-N-(5-methylisoxazol-3-yl)-
CID 1086353

Frequently Asked Questions

What is the IUPAC name of 3-amino-4,5,6-trimethyl-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 3-amino-4,5,6-trimethyl-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]pyridine-2-carboxamide (CID 948055) is 3-amino-4,5,6-trimethyl-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-4,5,6-trimethyl-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-4,5,6-trimethyl-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]pyridine-2-carboxamide is Cc1cc(NC(=O)c2sc3nc(C)c(C)c(C)c3c2N)no1.
What is the InChIKey of 3-amino-4,5,6-trimethyl-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is JONHPUKYDLPXRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O2S/c1-6-5-10(19-21-6)18-14(20)13-12(16)11-8(3)7(2)9(4)17-15(11)22-13/h5H,16H2,1-4H3,(H,18,19,20).
What are the key properties of 3-amino-4,5,6-trimethyl-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]pyridine-2-carboxamide?
3-amino-4,5,6-trimethyl-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 316.39 g/mol, XLogP of 3.35, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4,5,6-trimethyl-N-(5-methyl-1,2-oxazol-3-yl)thieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 948055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).