N,N-dimethyl-3-[(2S)-morpholin-2-yl]thieno[2,3-b]pyridine-2-carboxamide

C14H17N3O2S — CID 95804236

IUPACN,N-dimethyl-3-[(2S)-morpholin-2-yl]thieno[2,3-b]pyridine-2-carboxamide
SMILESCN(C)C(=O)c1sc2ncccc2c1[C@H]1CNCCO1
InChIInChI=1S/C14H17N3O2S/c1-17(2)14(18)12-11(10-8-15-6-7-19-10)9-4-3-5-16-13(9)20-12/h3-5,10,15H,6-8H2,1-2H3/t10-/m1/s1
InChIKeyYQRRNQFUNPWEHS-SNVBAGLBSA-N
MW291.38 g/mol
LogP1.66
Rot. Bonds2

About N,N-dimethyl-3-[(2S)-morpholin-2-yl]thieno[2,3-b]pyridine-2-carboxamide

N,N-dimethyl-3-[(2S)-morpholin-2-yl]thieno[2,3-b]pyridine-2-carboxamide (PubChem CID 95804236) has the molecular formula C14H17N3O2S and a molecular weight of 291.38 g/mol. Its IUPAC name is N,N-dimethyl-3-[(2S)-morpholin-2-yl]thieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-3-[(2S)-morpholin-2-yl]thieno[2,3-b]pyridine-2-carboxamide
PubChem CID95804236
Molecular FormulaC14H17N3O2S
Molecular Weight291.38 g/mol
Exact Mass291.10
IUPAC NameN,N-dimethyl-3-[(2S)-morpholin-2-yl]thieno[2,3-b]pyridine-2-carboxamide
SMILESCN(C)C(=O)c1sc2ncccc2c1[C@H]1CNCCO1
InChIInChI=1S/C14H17N3O2S/c1-17(2)14(18)12-11(10-8-15-6-7-19-10)9-4-3-5-16-13(9)20-12/h3-5,10,15H,6-8H2,1-2H3/t10-/m1/s1
InChIKeyYQRRNQFUNPWEHS-SNVBAGLBSA-N
XLogP1.66
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-[(2S)-morpholin-2-yl]thieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of N,N-dimethyl-3-[(2S)-morpholin-2-yl]thieno[2,3-b]pyridine-2-carboxamide (CID 95804236) is N,N-dimethyl-3-[(2S)-morpholin-2-yl]thieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for N,N-dimethyl-3-[(2S)-morpholin-2-yl]thieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for N,N-dimethyl-3-[(2S)-morpholin-2-yl]thieno[2,3-b]pyridine-2-carboxamide is CN(C)C(=O)c1sc2ncccc2c1[C@H]1CNCCO1.
What is the InChIKey of N,N-dimethyl-3-[(2S)-morpholin-2-yl]thieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is YQRRNQFUNPWEHS-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H17N3O2S/c1-17(2)14(18)12-11(10-8-15-6-7-19-10)9-4-3-5-16-13(9)20-12/h3-5,10,15H,6-8H2,1-2H3/t10-/m1/s1.
What are the key properties of N,N-dimethyl-3-[(2S)-morpholin-2-yl]thieno[2,3-b]pyridine-2-carboxamide?
N,N-dimethyl-3-[(2S)-morpholin-2-yl]thieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 291.38 g/mol, XLogP of 1.66, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-[(2S)-morpholin-2-yl]thieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 95804236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).