5-ethoxy-N-[(1-ethylpiperidin-3-yl)methyl]furan-2-carboxamide

C15H24N2O3 — CID 56702364

IUPAC5-ethoxy-N-[(1-ethylpiperidin-3-yl)methyl]furan-2-carboxamide
SMILESCCOc1ccc(C(=O)NCC2CCCN(CC)C2)o1
InChIInChI=1S/C15H24N2O3/c1-3-17-9-5-6-12(11-17)10-16-15(18)13-7-8-14(20-13)19-4-2/h7-8,12H,3-6,9-11H2,1-2H3,(H,16,18)
InChIKeyQRGFFACMNBLDTA-UHFFFAOYSA-N
MW280.37 g/mol
LogP2.14
Rot. Bonds6

About 5-ethoxy-N-[(1-ethylpiperidin-3-yl)methyl]furan-2-carboxamide

5-ethoxy-N-[(1-ethylpiperidin-3-yl)methyl]furan-2-carboxamide (PubChem CID 56702364) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is 5-ethoxy-N-[(1-ethylpiperidin-3-yl)methyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-ethoxy-N-[(1-ethylpiperidin-3-yl)methyl]furan-2-carboxamide
PubChem CID56702364
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name5-ethoxy-N-[(1-ethylpiperidin-3-yl)methyl]furan-2-carboxamide
SMILESCCOc1ccc(C(=O)NCC2CCCN(CC)C2)o1
InChIInChI=1S/C15H24N2O3/c1-3-17-9-5-6-12(11-17)10-16-15(18)13-7-8-14(20-13)19-4-2/h7-8,12H,3-6,9-11H2,1-2H3,(H,16,18)
InChIKeyQRGFFACMNBLDTA-UHFFFAOYSA-N
XLogP2.14
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-ethoxy-N-[(1-ethylpiperidin-3-yl)methyl]furan-2-carboxamide?
The IUPAC name of 5-ethoxy-N-[(1-ethylpiperidin-3-yl)methyl]furan-2-carboxamide (CID 56702364) is 5-ethoxy-N-[(1-ethylpiperidin-3-yl)methyl]furan-2-carboxamide.
What is the SMILES notation for 5-ethoxy-N-[(1-ethylpiperidin-3-yl)methyl]furan-2-carboxamide?
The canonical SMILES for 5-ethoxy-N-[(1-ethylpiperidin-3-yl)methyl]furan-2-carboxamide is CCOc1ccc(C(=O)NCC2CCCN(CC)C2)o1.
What is the InChIKey of 5-ethoxy-N-[(1-ethylpiperidin-3-yl)methyl]furan-2-carboxamide?
The InChIKey is QRGFFACMNBLDTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-3-17-9-5-6-12(11-17)10-16-15(18)13-7-8-14(20-13)19-4-2/h7-8,12H,3-6,9-11H2,1-2H3,(H,16,18).
What are the key properties of 5-ethoxy-N-[(1-ethylpiperidin-3-yl)methyl]furan-2-carboxamide?
5-ethoxy-N-[(1-ethylpiperidin-3-yl)methyl]furan-2-carboxamide has a molecular weight of 280.37 g/mol, XLogP of 2.14, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethoxy-N-[(1-ethylpiperidin-3-yl)methyl]furan-2-carboxamide is sourced from PubChem (CID 56702364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).