N-[2-(furan-2-yl)-2-thiophen-2-ylethyl]oxolane-3-carboxamide

C15H17NO3S — CID 126852531

IUPACN-[2-(furan-2-yl)-2-thiophen-2-ylethyl]oxolane-3-carboxamide
SMILESO=C(NCC(c1ccco1)c1cccs1)C1CCOC1
InChIInChI=1S/C15H17NO3S/c17-15(11-5-7-18-10-11)16-9-12(13-3-1-6-19-13)14-4-2-8-20-14/h1-4,6,8,11-12H,5,7,9-10H2,(H,16,17)
InChIKeyRJBDTPGSYAWZHV-UHFFFAOYSA-N
MW291.37 g/mol
LogP2.63
Rot. Bonds5

About N-[2-(furan-2-yl)-2-thiophen-2-ylethyl]oxolane-3-carboxamide

N-[2-(furan-2-yl)-2-thiophen-2-ylethyl]oxolane-3-carboxamide (PubChem CID 126852531) has the molecular formula C15H17NO3S and a molecular weight of 291.37 g/mol. Its IUPAC name is N-[2-(furan-2-yl)-2-thiophen-2-ylethyl]oxolane-3-carboxamide.

Molecular Properties

Compound NameN-[2-(furan-2-yl)-2-thiophen-2-ylethyl]oxolane-3-carboxamide
PubChem CID126852531
Molecular FormulaC15H17NO3S
Molecular Weight291.37 g/mol
Exact Mass291.09
IUPAC NameN-[2-(furan-2-yl)-2-thiophen-2-ylethyl]oxolane-3-carboxamide
SMILESO=C(NCC(c1ccco1)c1cccs1)C1CCOC1
InChIInChI=1S/C15H17NO3S/c17-15(11-5-7-18-10-11)16-9-12(13-3-1-6-19-13)14-4-2-8-20-14/h1-4,6,8,11-12H,5,7,9-10H2,(H,16,17)
InChIKeyRJBDTPGSYAWZHV-UHFFFAOYSA-N
XLogP2.63
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.37
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3R)-3-[[(3S)-oxolane-3-carbonyl]amino]-3-thiophen-2-ylpropanoic acid
CID 124704357
(3S)-3-[[(3S)-oxolane-3-carbonyl]amino]-3-thiophen-2-ylpropanoic acid
CID 124700640
N-[2-hydroxy-2-(5-thiophen-2-ylthiophen-2-yl)ethyl]oxolane-3-carboxamide
CID 126852682
N-[2-(furan-2-yl)-2-thiophen-2-ylethyl]-4-phenyloxane-4-carboxamide
CID 126850412
(3R)-3-[[(3S)-oxane-3-carbonyl]amino]-3-thiophen-2-ylpropanoic acid
CID 124704349
N-[2-(furan-2-yl)-2-thiophen-2-ylethyl]-2-methylsulfanylbenzamide
CID 126850403
N-[2-(furan-2-yl)-2-thiophen-2-ylethyl]-N'-(1,2-oxazol-3-yl)oxamide
CID 126852085
N-[2-(furan-2-yl)-2-thiophen-2-ylethyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 126850409
N-[2-(furan-2-yl)-2-thiophen-2-ylethyl]-2-phenyl-1,3-thiazole-4-carboxamide
CID 126854746
2-[[cyclopropyl(thiophen-2-yl)methyl]amino]-1-(furan-2-yl)ethanol
CID 110888252
N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-1-(oxan-4-yl)piperidine-4-carboxamide
CID 74233287
4-(dimethylsulfamoyl)-N-[2-(furan-2-yl)-2-thiophen-2-ylethyl]benzamide
CID 126850416

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)-2-thiophen-2-ylethyl]oxolane-3-carboxamide?
The IUPAC name of N-[2-(furan-2-yl)-2-thiophen-2-ylethyl]oxolane-3-carboxamide (CID 126852531) is N-[2-(furan-2-yl)-2-thiophen-2-ylethyl]oxolane-3-carboxamide.
What is the SMILES notation for N-[2-(furan-2-yl)-2-thiophen-2-ylethyl]oxolane-3-carboxamide?
The canonical SMILES for N-[2-(furan-2-yl)-2-thiophen-2-ylethyl]oxolane-3-carboxamide is O=C(NCC(c1ccco1)c1cccs1)C1CCOC1.
What is the InChIKey of N-[2-(furan-2-yl)-2-thiophen-2-ylethyl]oxolane-3-carboxamide?
The InChIKey is RJBDTPGSYAWZHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3S/c17-15(11-5-7-18-10-11)16-9-12(13-3-1-6-19-13)14-4-2-8-20-14/h1-4,6,8,11-12H,5,7,9-10H2,(H,16,17).
What are the key properties of N-[2-(furan-2-yl)-2-thiophen-2-ylethyl]oxolane-3-carboxamide?
N-[2-(furan-2-yl)-2-thiophen-2-ylethyl]oxolane-3-carboxamide has a molecular weight of 291.37 g/mol, XLogP of 2.63, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)-2-thiophen-2-ylethyl]oxolane-3-carboxamide is sourced from PubChem (CID 126852531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).