(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone

C15H19N3O2S — CID 114683837

IUPAC(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone
SMILESCc1ccnc2sc(C(=O)N3CCC(O)C(C)C3)c(N)c12
InChIInChI=1S/C15H19N3O2S/c1-8-3-5-17-14-11(8)12(16)13(21-14)15(20)18-6-4-10(19)9(2)7-18/h3,5,9-10,19H,4,6-7,16H2,1-2H3
InChIKeySSYSCXQUJIYEDY-UHFFFAOYSA-N
MW305.40 g/mol
LogP2.03
Rot. Bonds1

About (3-amino-4-methylthieno[2,3-b]pyridin-2-yl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone

(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone (PubChem CID 114683837) has the molecular formula C15H19N3O2S and a molecular weight of 305.40 g/mol. Its IUPAC name is (3-amino-4-methylthieno[2,3-b]pyridin-2-yl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone
PubChem CID114683837
Molecular FormulaC15H19N3O2S
Molecular Weight305.40 g/mol
Exact Mass305.12
IUPAC Name(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone
SMILESCc1ccnc2sc(C(=O)N3CCC(O)C(C)C3)c(N)c12
InChIInChI=1S/C15H19N3O2S/c1-8-3-5-17-14-11(8)12(16)13(21-14)15(20)18-6-4-10(19)9(2)7-18/h3,5,9-10,19H,4,6-7,16H2,1-2H3
InChIKeySSYSCXQUJIYEDY-UHFFFAOYSA-N
XLogP2.03
TPSA79.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (3-amino-4-methylthieno[2,3-b]pyridin-2-yl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone with MolForge

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Related Compounds

(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)-(3-methoxypiperidin-1-yl)methanone
CID 102970996
(4-amino-1,3-dimethylthieno[3,2-d]pyrazol-5-yl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone
CID 114683836
(3S,4S)-1-(3,4-dimethylthieno[2,3-b]pyridine-2-carbonyl)-4-methylpyrrolidine-3-carboxylic acid
CID 122112165
(2-amino-4-methyl-1,3-thiazol-5-yl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone
CID 114678315
(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)-[4-(2-fluorophenyl)piperazin-1-yl]methanone
CID 171133137
1-(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)ethanone
CID 82395893
(4-hydroxy-3-methylpiperidin-1-yl)-(2-methyl-1,3-thiazol-5-yl)methanone
CID 104956593
(2-amino-3-methylphenyl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone
CID 114677500
(4-hydroxy-3-methylpiperidin-1-yl)-(4-methylthiadiazol-5-yl)methanone
CID 114680256
(2-amino-3-pyridinyl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone
CID 114681656
(2-fluoro-4-pyridinyl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone
CID 114678232
(3-amino-1-benzothiophen-2-yl)-(3-hydroxy-4-methylpiperidin-1-yl)methanone
CID 102970975

Frequently Asked Questions

What is the IUPAC name of (3-amino-4-methylthieno[2,3-b]pyridin-2-yl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone?
The IUPAC name of (3-amino-4-methylthieno[2,3-b]pyridin-2-yl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone (CID 114683837) is (3-amino-4-methylthieno[2,3-b]pyridin-2-yl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone.
What is the SMILES notation for (3-amino-4-methylthieno[2,3-b]pyridin-2-yl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone?
The canonical SMILES for (3-amino-4-methylthieno[2,3-b]pyridin-2-yl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone is Cc1ccnc2sc(C(=O)N3CCC(O)C(C)C3)c(N)c12.
What is the InChIKey of (3-amino-4-methylthieno[2,3-b]pyridin-2-yl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone?
The InChIKey is SSYSCXQUJIYEDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2S/c1-8-3-5-17-14-11(8)12(16)13(21-14)15(20)18-6-4-10(19)9(2)7-18/h3,5,9-10,19H,4,6-7,16H2,1-2H3.
What are the key properties of (3-amino-4-methylthieno[2,3-b]pyridin-2-yl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone?
(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone has a molecular weight of 305.40 g/mol, XLogP of 2.03, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-amino-4-methylthieno[2,3-b]pyridin-2-yl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 114683837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).