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

C14H16N2O2S — CID 18143995

IUPACN-[2-(furan-2-yl)ethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
SMILESO=C(NCCc1ccco1)N1CCc2sccc2C1
InChIInChI=1S/C14H16N2O2S/c17-14(15-6-3-12-2-1-8-18-12)16-7-4-13-11(10-16)5-9-19-13/h1-2,5,8-9H,3-4,6-7,10H2,(H,15,17)
InChIKeyUBMHICGWDOLCNS-UHFFFAOYSA-N
MW276.36 g/mol
LogP2.65
Rot. Bonds3

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

N-[2-(furan-2-yl)ethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide (PubChem CID 18143995) has the molecular formula C14H16N2O2S and a molecular weight of 276.36 g/mol. Its IUPAC name is N-[2-(furan-2-yl)ethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide.

Molecular Properties

Compound NameN-[2-(furan-2-yl)ethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
PubChem CID18143995
Molecular FormulaC14H16N2O2S
Molecular Weight276.36 g/mol
Exact Mass276.09
IUPAC NameN-[2-(furan-2-yl)ethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
SMILESO=C(NCCc1ccco1)N1CCc2sccc2C1
InChIInChI=1S/C14H16N2O2S/c17-14(15-6-3-12-2-1-8-18-12)16-7-4-13-11(10-16)5-9-19-13/h1-2,5,8-9H,3-4,6-7,10H2,(H,15,17)
InChIKeyUBMHICGWDOLCNS-UHFFFAOYSA-N
XLogP2.65
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)ethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide?
The IUPAC name of N-[2-(furan-2-yl)ethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide (CID 18143995) is N-[2-(furan-2-yl)ethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide.
What is the SMILES notation for N-[2-(furan-2-yl)ethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide?
The canonical SMILES for N-[2-(furan-2-yl)ethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide is O=C(NCCc1ccco1)N1CCc2sccc2C1.
What is the InChIKey of N-[2-(furan-2-yl)ethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide?
The InChIKey is UBMHICGWDOLCNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2S/c17-14(15-6-3-12-2-1-8-18-12)16-7-4-13-11(10-16)5-9-19-13/h1-2,5,8-9H,3-4,6-7,10H2,(H,15,17).
What are the key properties of N-[2-(furan-2-yl)ethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide?
N-[2-(furan-2-yl)ethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide has a molecular weight of 276.36 g/mol, XLogP of 2.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)ethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide is sourced from PubChem (CID 18143995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).