(3-aminothieno[3,2-b]pyridin-2-yl)-[(2S,6R)-2,6-dimethylmorpholin-4-yl]methanone

C14H17N3O2S — CID 104961431

IUPAC(3-aminothieno[3,2-b]pyridin-2-yl)-[(2S,6R)-2,6-dimethylmorpholin-4-yl]methanone
SMILESC[C@@H]1CN(C(=O)c2sc3cccnc3c2N)C[C@H](C)O1
InChIInChI=1S/C14H17N3O2S/c1-8-6-17(7-9(2)19-8)14(18)13-11(15)12-10(20-13)4-3-5-16-12/h3-5,8-9H,6-7,15H2,1-2H3/t8-,9+
InChIKeyFLMUTWPGRWBXCH-DTORHVGOSA-N
MW291.38 g/mol
LogP2.13
Rot. Bonds1

About (3-aminothieno[3,2-b]pyridin-2-yl)-[(2S,6R)-2,6-dimethylmorpholin-4-yl]methanone

(3-aminothieno[3,2-b]pyridin-2-yl)-[(2S,6R)-2,6-dimethylmorpholin-4-yl]methanone (PubChem CID 104961431) has the molecular formula C14H17N3O2S and a molecular weight of 291.38 g/mol. Its IUPAC name is (3-aminothieno[3,2-b]pyridin-2-yl)-[(2S,6R)-2,6-dimethylmorpholin-4-yl]methanone.

Molecular Properties

Compound Name(3-aminothieno[3,2-b]pyridin-2-yl)-[(2S,6R)-2,6-dimethylmorpholin-4-yl]methanone
PubChem CID104961431
Molecular FormulaC14H17N3O2S
Molecular Weight291.38 g/mol
Exact Mass291.10
IUPAC Name(3-aminothieno[3,2-b]pyridin-2-yl)-[(2S,6R)-2,6-dimethylmorpholin-4-yl]methanone
SMILESC[C@@H]1CN(C(=O)c2sc3cccnc3c2N)C[C@H](C)O1
InChIInChI=1S/C14H17N3O2S/c1-8-6-17(7-9(2)19-8)14(18)13-11(15)12-10(20-13)4-3-5-16-12/h3-5,8-9H,6-7,15H2,1-2H3/t8-,9+
InChIKeyFLMUTWPGRWBXCH-DTORHVGOSA-N
XLogP2.13
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (3-aminothieno[3,2-b]pyridin-2-yl)-[(2S,6R)-2,6-dimethylmorpholin-4-yl]methanone with MolForge

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Related Compounds

(7-aminothieno[2,3-b]pyrazin-6-yl)-[(2S,6R)-2,6-dimethylmorpholin-4-yl]methanone
CID 104961425
(3-aminothieno[3,2-b]pyridin-2-yl)-[3-(hydroxymethyl)pyrrolidin-1-yl]methanone
CID 112629406
(3-aminothieno[3,2-b]pyridin-2-yl)-(2,3,5-trimethylpiperidin-1-yl)methanone
CID 114597600
4-(3-aminothieno[3,2-b]pyridine-2-carbonyl)-1-methyl-1,4-diazepan-2-one
CID 102893030
(3-amino-5-bromo-1-benzothiophen-2-yl)-(2,6-dimethylmorpholin-4-yl)methanone
CID 114896329
(4-amino-1,3-dimethylthieno[3,2-d]pyrazol-5-yl)-[(2S,6R)-2,6-dimethylmorpholin-4-yl]methanone
CID 104961435
(2-amino-4-methyl-1,3-thiazol-5-yl)-(2,6-dimethylmorpholin-4-yl)methanone
CID 62792174
(3-tert-butyl-2-pyridinyl)-(2,6-dimethylmorpholin-4-yl)methanone
CID 89458475
(3-chloro-1-benzothiophen-2-yl)-[(2S,6S)-2,6-dimethylmorpholin-4-yl]methanone
CID 889572
[(2S,6S)-2,6-dimethylmorpholin-4-yl]-(2-methylsulfanyl-3-pyridinyl)methanone
CID 39902934
(2-amino-4-pyridinyl)-(2,6-dimethylmorpholin-4-yl)methanone
CID 55043295
(2,6-dimethylmorpholin-4-yl)-(2-pyrrolidin-1-yl-3-pyridinyl)methanone
CID 134016503

Frequently Asked Questions

What is the IUPAC name of (3-aminothieno[3,2-b]pyridin-2-yl)-[(2S,6R)-2,6-dimethylmorpholin-4-yl]methanone?
The IUPAC name of (3-aminothieno[3,2-b]pyridin-2-yl)-[(2S,6R)-2,6-dimethylmorpholin-4-yl]methanone (CID 104961431) is (3-aminothieno[3,2-b]pyridin-2-yl)-[(2S,6R)-2,6-dimethylmorpholin-4-yl]methanone.
What is the SMILES notation for (3-aminothieno[3,2-b]pyridin-2-yl)-[(2S,6R)-2,6-dimethylmorpholin-4-yl]methanone?
The canonical SMILES for (3-aminothieno[3,2-b]pyridin-2-yl)-[(2S,6R)-2,6-dimethylmorpholin-4-yl]methanone is C[C@@H]1CN(C(=O)c2sc3cccnc3c2N)C[C@H](C)O1.
What is the InChIKey of (3-aminothieno[3,2-b]pyridin-2-yl)-[(2S,6R)-2,6-dimethylmorpholin-4-yl]methanone?
The InChIKey is FLMUTWPGRWBXCH-DTORHVGOSA-N. The full InChI is InChI=1S/C14H17N3O2S/c1-8-6-17(7-9(2)19-8)14(18)13-11(15)12-10(20-13)4-3-5-16-12/h3-5,8-9H,6-7,15H2,1-2H3/t8-,9+.
What are the key properties of (3-aminothieno[3,2-b]pyridin-2-yl)-[(2S,6R)-2,6-dimethylmorpholin-4-yl]methanone?
(3-aminothieno[3,2-b]pyridin-2-yl)-[(2S,6R)-2,6-dimethylmorpholin-4-yl]methanone has a molecular weight of 291.38 g/mol, XLogP of 2.13, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminothieno[3,2-b]pyridin-2-yl)-[(2S,6R)-2,6-dimethylmorpholin-4-yl]methanone is sourced from PubChem (CID 104961431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).