3-amino-N-[(3-methylcyclopentyl)methyl]thieno[2,3-b]pyridine-2-carboxamide

C15H19N3OS — CID 107415732

IUPAC3-amino-N-[(3-methylcyclopentyl)methyl]thieno[2,3-b]pyridine-2-carboxamide
SMILESCC1CCC(CNC(=O)c2sc3ncccc3c2N)C1
InChIInChI=1S/C15H19N3OS/c1-9-4-5-10(7-9)8-18-14(19)13-12(16)11-3-2-6-17-15(11)20-13/h2-3,6,9-10H,4-5,7-8,16H2,1H3,(H,18,19)
InChIKeyFYQFBCWQDQOESA-UHFFFAOYSA-N
MW289.40 g/mol
LogP3.04
Rot. Bonds3

About 3-amino-N-[(3-methylcyclopentyl)methyl]thieno[2,3-b]pyridine-2-carboxamide

3-amino-N-[(3-methylcyclopentyl)methyl]thieno[2,3-b]pyridine-2-carboxamide (PubChem CID 107415732) has the molecular formula C15H19N3OS and a molecular weight of 289.40 g/mol. Its IUPAC name is 3-amino-N-[(3-methylcyclopentyl)methyl]thieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-[(3-methylcyclopentyl)methyl]thieno[2,3-b]pyridine-2-carboxamide
PubChem CID107415732
Molecular FormulaC15H19N3OS
Molecular Weight289.40 g/mol
Exact Mass289.12
IUPAC Name3-amino-N-[(3-methylcyclopentyl)methyl]thieno[2,3-b]pyridine-2-carboxamide
SMILESCC1CCC(CNC(=O)c2sc3ncccc3c2N)C1
InChIInChI=1S/C15H19N3OS/c1-9-4-5-10(7-9)8-18-14(19)13-12(16)11-3-2-6-17-15(11)20-13/h2-3,6,9-10H,4-5,7-8,16H2,1H3,(H,18,19)
InChIKeyFYQFBCWQDQOESA-UHFFFAOYSA-N
XLogP3.04
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[(3-methylcyclopentyl)methyl]thieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-[(3-methylcyclopentyl)methyl]thieno[2,3-b]pyridine-2-carboxamide (CID 107415732) is 3-amino-N-[(3-methylcyclopentyl)methyl]thieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-[(3-methylcyclopentyl)methyl]thieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-[(3-methylcyclopentyl)methyl]thieno[2,3-b]pyridine-2-carboxamide is CC1CCC(CNC(=O)c2sc3ncccc3c2N)C1.
What is the InChIKey of 3-amino-N-[(3-methylcyclopentyl)methyl]thieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is FYQFBCWQDQOESA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3OS/c1-9-4-5-10(7-9)8-18-14(19)13-12(16)11-3-2-6-17-15(11)20-13/h2-3,6,9-10H,4-5,7-8,16H2,1H3,(H,18,19).
What are the key properties of 3-amino-N-[(3-methylcyclopentyl)methyl]thieno[2,3-b]pyridine-2-carboxamide?
3-amino-N-[(3-methylcyclopentyl)methyl]thieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 289.40 g/mol, XLogP of 3.04, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[(3-methylcyclopentyl)methyl]thieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 107415732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).