5-chloro-N-[2-(furan-3-yl)ethyl]thiophene-2-carboxamide

C11H10ClNO2S — CID 71798443

IUPAC5-chloro-N-[2-(furan-3-yl)ethyl]thiophene-2-carboxamide
SMILESO=C(NCCc1ccoc1)c1ccc(Cl)s1
InChIInChI=1S/C11H10ClNO2S/c12-10-2-1-9(16-10)11(14)13-5-3-8-4-6-15-7-8/h1-2,4,6-7H,3,5H2,(H,13,14)
InChIKeyINJLDPLHPKZFSO-UHFFFAOYSA-N
MW255.73 g/mol
LogP2.97
Rot. Bonds4

About 5-chloro-N-[2-(furan-3-yl)ethyl]thiophene-2-carboxamide

5-chloro-N-[2-(furan-3-yl)ethyl]thiophene-2-carboxamide (PubChem CID 71798443) has the molecular formula C11H10ClNO2S and a molecular weight of 255.73 g/mol. Its IUPAC name is 5-chloro-N-[2-(furan-3-yl)ethyl]thiophene-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[2-(furan-3-yl)ethyl]thiophene-2-carboxamide
PubChem CID71798443
Molecular FormulaC11H10ClNO2S
Molecular Weight255.73 g/mol
Exact Mass255.01
IUPAC Name5-chloro-N-[2-(furan-3-yl)ethyl]thiophene-2-carboxamide
SMILESO=C(NCCc1ccoc1)c1ccc(Cl)s1
InChIInChI=1S/C11H10ClNO2S/c12-10-2-1-9(16-10)11(14)13-5-3-8-4-6-15-7-8/h1-2,4,6-7H,3,5H2,(H,13,14)
InChIKeyINJLDPLHPKZFSO-UHFFFAOYSA-N
XLogP2.97
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.73
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[2-(furan-3-yl)ethyl]thiophene-2-carboxamide?
The IUPAC name of 5-chloro-N-[2-(furan-3-yl)ethyl]thiophene-2-carboxamide (CID 71798443) is 5-chloro-N-[2-(furan-3-yl)ethyl]thiophene-2-carboxamide.
What is the SMILES notation for 5-chloro-N-[2-(furan-3-yl)ethyl]thiophene-2-carboxamide?
The canonical SMILES for 5-chloro-N-[2-(furan-3-yl)ethyl]thiophene-2-carboxamide is O=C(NCCc1ccoc1)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-[2-(furan-3-yl)ethyl]thiophene-2-carboxamide?
The InChIKey is INJLDPLHPKZFSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClNO2S/c12-10-2-1-9(16-10)11(14)13-5-3-8-4-6-15-7-8/h1-2,4,6-7H,3,5H2,(H,13,14).
What are the key properties of 5-chloro-N-[2-(furan-3-yl)ethyl]thiophene-2-carboxamide?
5-chloro-N-[2-(furan-3-yl)ethyl]thiophene-2-carboxamide has a molecular weight of 255.73 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[2-(furan-3-yl)ethyl]thiophene-2-carboxamide is sourced from PubChem (CID 71798443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).