N-[(2S)-1-(furan-2-yl)propan-2-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide

C15H18N2O2S — CID 35685558

IUPACN-[(2S)-1-(furan-2-yl)propan-2-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
SMILESC[C@@H](Cc1ccco1)NC(=O)N1CCc2sccc2C1
InChIInChI=1S/C15H18N2O2S/c1-11(9-13-3-2-7-19-13)16-15(18)17-6-4-14-12(10-17)5-8-20-14/h2-3,5,7-8,11H,4,6,9-10H2,1H3,(H,16,18)/t11-/m0/s1
InChIKeyNKHIFXSLEMULAI-NSHDSACASA-N
MW290.39 g/mol
LogP3.04
Rot. Bonds3

About N-[(2S)-1-(furan-2-yl)propan-2-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide

N-[(2S)-1-(furan-2-yl)propan-2-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide (PubChem CID 35685558) has the molecular formula C15H18N2O2S and a molecular weight of 290.39 g/mol. Its IUPAC name is N-[(2S)-1-(furan-2-yl)propan-2-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide.

Molecular Properties

Compound NameN-[(2S)-1-(furan-2-yl)propan-2-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
PubChem CID35685558
Molecular FormulaC15H18N2O2S
Molecular Weight290.39 g/mol
Exact Mass290.11
IUPAC NameN-[(2S)-1-(furan-2-yl)propan-2-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
SMILESC[C@@H](Cc1ccco1)NC(=O)N1CCc2sccc2C1
InChIInChI=1S/C15H18N2O2S/c1-11(9-13-3-2-7-19-13)16-15(18)17-6-4-14-12(10-17)5-8-20-14/h2-3,5,7-8,11H,4,6,9-10H2,1H3,(H,16,18)/t11-/m0/s1
InChIKeyNKHIFXSLEMULAI-NSHDSACASA-N
XLogP3.04
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-(furan-2-yl)propan-2-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide?
The IUPAC name of N-[(2S)-1-(furan-2-yl)propan-2-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide (CID 35685558) is N-[(2S)-1-(furan-2-yl)propan-2-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide.
What is the SMILES notation for N-[(2S)-1-(furan-2-yl)propan-2-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide?
The canonical SMILES for N-[(2S)-1-(furan-2-yl)propan-2-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide is C[C@@H](Cc1ccco1)NC(=O)N1CCc2sccc2C1.
What is the InChIKey of N-[(2S)-1-(furan-2-yl)propan-2-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide?
The InChIKey is NKHIFXSLEMULAI-NSHDSACASA-N. The full InChI is InChI=1S/C15H18N2O2S/c1-11(9-13-3-2-7-19-13)16-15(18)17-6-4-14-12(10-17)5-8-20-14/h2-3,5,7-8,11H,4,6,9-10H2,1H3,(H,16,18)/t11-/m0/s1.
What are the key properties of N-[(2S)-1-(furan-2-yl)propan-2-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide?
N-[(2S)-1-(furan-2-yl)propan-2-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide has a molecular weight of 290.39 g/mol, XLogP of 3.04, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-(furan-2-yl)propan-2-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide is sourced from PubChem (CID 35685558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).