methyl 4-amino-3-methylthieno[3,2-c]pyridine-7-carboxylate

C10H10N2O2S — CID 135393998

IUPACmethyl 4-amino-3-methylthieno[3,2-c]pyridine-7-carboxylate
SMILESCOC(=O)c1cnc(N)c2c(C)csc12
InChIInChI=1S/C10H10N2O2S/c1-5-4-15-8-6(10(13)14-2)3-12-9(11)7(5)8/h3-4H,1-2H3,(H2,11,12)
InChIKeyZAXUWUBDZOEZNX-UHFFFAOYSA-N
MW222.27 g/mol
LogP1.97
Rot. Bonds1

About methyl 4-amino-3-methylthieno[3,2-c]pyridine-7-carboxylate

methyl 4-amino-3-methylthieno[3,2-c]pyridine-7-carboxylate (PubChem CID 135393998) has the molecular formula C10H10N2O2S and a molecular weight of 222.27 g/mol. Its IUPAC name is methyl 4-amino-3-methylthieno[3,2-c]pyridine-7-carboxylate.

Molecular Properties

Compound Namemethyl 4-amino-3-methylthieno[3,2-c]pyridine-7-carboxylate
PubChem CID135393998
Molecular FormulaC10H10N2O2S
Molecular Weight222.27 g/mol
Exact Mass222.05
IUPAC Namemethyl 4-amino-3-methylthieno[3,2-c]pyridine-7-carboxylate
SMILESCOC(=O)c1cnc(N)c2c(C)csc12
InChIInChI=1S/C10H10N2O2S/c1-5-4-15-8-6(10(13)14-2)3-12-9(11)7(5)8/h3-4H,1-2H3,(H2,11,12)
InChIKeyZAXUWUBDZOEZNX-UHFFFAOYSA-N
XLogP1.97
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.27
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 7-aminothieno[2,3-c]pyridine-4-carboxylate
CID 135394308
methyl 3-methylthieno[3,2-b]pyridine-7-carboxylate
CID 130905624
methyl 4-amino-3-[4-[[3-(aminomethyl)phenyl]carbamoylamino]phenyl]thieno[3,2-c]pyridine-7-carboxylate
CID 150476831
methyl 2,5-diaminopyridine-3-carboxylate
CID 83792494
methyl 7-bromo-4-methyl-1-benzothiophene-3-carboxylate
CID 155463767
methyl 4-amino-8-bromo-5-methylquinoline-3-carboxylate
CID 102614908
methyl 4-amino-2-(methylamino)pyrimidine-5-carboxylate
CID 116646751
methyl 7-methyl-1,2-benzothiazole-4-carboxylate
CID 130064177
ethyl 4-amino-3-[[3-[(4-methoxyphenyl)methoxy]phenoxy]methyl]thieno[3,2-c]pyridine-7-carboxylate;methane
CID 160618390
ethyl 4-amino-3-[(3-phenoxyphenoxy)methyl]thieno[3,2-c]pyridine-7-carboxylate;methane
CID 162100170
methyl 4-(6-amino-5-methyl-3-pyridinyl)benzoate
CID 82556066
methyl 3-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
CID 75412267

Frequently Asked Questions

What is the IUPAC name of methyl 4-amino-3-methylthieno[3,2-c]pyridine-7-carboxylate?
The IUPAC name of methyl 4-amino-3-methylthieno[3,2-c]pyridine-7-carboxylate (CID 135393998) is methyl 4-amino-3-methylthieno[3,2-c]pyridine-7-carboxylate.
What is the SMILES notation for methyl 4-amino-3-methylthieno[3,2-c]pyridine-7-carboxylate?
The canonical SMILES for methyl 4-amino-3-methylthieno[3,2-c]pyridine-7-carboxylate is COC(=O)c1cnc(N)c2c(C)csc12.
What is the InChIKey of methyl 4-amino-3-methylthieno[3,2-c]pyridine-7-carboxylate?
The InChIKey is ZAXUWUBDZOEZNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2S/c1-5-4-15-8-6(10(13)14-2)3-12-9(11)7(5)8/h3-4H,1-2H3,(H2,11,12).
What are the key properties of methyl 4-amino-3-methylthieno[3,2-c]pyridine-7-carboxylate?
methyl 4-amino-3-methylthieno[3,2-c]pyridine-7-carboxylate has a molecular weight of 222.27 g/mol, XLogP of 1.97, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-amino-3-methylthieno[3,2-c]pyridine-7-carboxylate is sourced from PubChem (CID 135393998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).