3-amino-4-cyclohexyloxythieno[2,3-b]pyridine-2-carboxamide

C14H17N3O2S — CID 69366963

IUPAC3-amino-4-cyclohexyloxythieno[2,3-b]pyridine-2-carboxamide
SMILESNC(=O)c1sc2nccc(OC3CCCCC3)c2c1N
InChIInChI=1S/C14H17N3O2S/c15-11-10-9(19-8-4-2-1-3-5-8)6-7-17-14(10)20-12(11)13(16)18/h6-8H,1-5,15H2,(H2,16,18)
InChIKeySKXXCAJQBOAUMZ-UHFFFAOYSA-N
MW291.38 g/mol
LogP2.69
Rot. Bonds3

About 3-amino-4-cyclohexyloxythieno[2,3-b]pyridine-2-carboxamide

3-amino-4-cyclohexyloxythieno[2,3-b]pyridine-2-carboxamide (PubChem CID 69366963) has the molecular formula C14H17N3O2S and a molecular weight of 291.38 g/mol. Its IUPAC name is 3-amino-4-cyclohexyloxythieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-4-cyclohexyloxythieno[2,3-b]pyridine-2-carboxamide
PubChem CID69366963
Molecular FormulaC14H17N3O2S
Molecular Weight291.38 g/mol
Exact Mass291.10
IUPAC Name3-amino-4-cyclohexyloxythieno[2,3-b]pyridine-2-carboxamide
SMILESNC(=O)c1sc2nccc(OC3CCCCC3)c2c1N
InChIInChI=1S/C14H17N3O2S/c15-11-10-9(19-8-4-2-1-3-5-8)6-7-17-14(10)20-12(11)13(16)18/h6-8H,1-5,15H2,(H2,16,18)
InChIKeySKXXCAJQBOAUMZ-UHFFFAOYSA-N
XLogP2.69
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-amino-4-cyclohexyloxythieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 3-amino-4-cyclohexyloxythieno[2,3-b]pyridine-2-carboxamide (CID 69366963) is 3-amino-4-cyclohexyloxythieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-4-cyclohexyloxythieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-4-cyclohexyloxythieno[2,3-b]pyridine-2-carboxamide is NC(=O)c1sc2nccc(OC3CCCCC3)c2c1N.
What is the InChIKey of 3-amino-4-cyclohexyloxythieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is SKXXCAJQBOAUMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2S/c15-11-10-9(19-8-4-2-1-3-5-8)6-7-17-14(10)20-12(11)13(16)18/h6-8H,1-5,15H2,(H2,16,18).
What are the key properties of 3-amino-4-cyclohexyloxythieno[2,3-b]pyridine-2-carboxamide?
3-amino-4-cyclohexyloxythieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 291.38 g/mol, XLogP of 2.69, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4-cyclohexyloxythieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 69366963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).