N-[1-[2-(4-hydroxyphenoxy)propanoyl]piperidin-4-yl]furan-2-carboxamide

C19H22N2O5 — CID 108550032

IUPACN-[1-[2-(4-hydroxyphenoxy)propanoyl]piperidin-4-yl]furan-2-carboxamide
SMILESCC(Oc1ccc(O)cc1)C(=O)N1CCC(NC(=O)c2ccco2)CC1
InChIInChI=1S/C19H22N2O5/c1-13(26-16-6-4-15(22)5-7-16)19(24)21-10-8-14(9-11-21)20-18(23)17-3-2-12-25-17/h2-7,12-14,22H,8-11H2,1H3,(H,20,23)
InChIKeyYCEIFCAVSUBYAN-UHFFFAOYSA-N
MW358.39 g/mol
LogP2.17
Rot. Bonds5

About N-[1-[2-(4-hydroxyphenoxy)propanoyl]piperidin-4-yl]furan-2-carboxamide

N-[1-[2-(4-hydroxyphenoxy)propanoyl]piperidin-4-yl]furan-2-carboxamide (PubChem CID 108550032) has the molecular formula C19H22N2O5 and a molecular weight of 358.39 g/mol. Its IUPAC name is N-[1-[2-(4-hydroxyphenoxy)propanoyl]piperidin-4-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[1-[2-(4-hydroxyphenoxy)propanoyl]piperidin-4-yl]furan-2-carboxamide
PubChem CID108550032
Molecular FormulaC19H22N2O5
Molecular Weight358.39 g/mol
Exact Mass358.15
IUPAC NameN-[1-[2-(4-hydroxyphenoxy)propanoyl]piperidin-4-yl]furan-2-carboxamide
SMILESCC(Oc1ccc(O)cc1)C(=O)N1CCC(NC(=O)c2ccco2)CC1
InChIInChI=1S/C19H22N2O5/c1-13(26-16-6-4-15(22)5-7-16)19(24)21-10-8-14(9-11-21)20-18(23)17-3-2-12-25-17/h2-7,12-14,22H,8-11H2,1H3,(H,20,23)
InChIKeyYCEIFCAVSUBYAN-UHFFFAOYSA-N
XLogP2.17
TPSA92.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.39
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(4-hydroxyphenoxy)propanoyl]piperidin-4-yl]furan-2-carboxamide?
The IUPAC name of N-[1-[2-(4-hydroxyphenoxy)propanoyl]piperidin-4-yl]furan-2-carboxamide (CID 108550032) is N-[1-[2-(4-hydroxyphenoxy)propanoyl]piperidin-4-yl]furan-2-carboxamide.
What is the SMILES notation for N-[1-[2-(4-hydroxyphenoxy)propanoyl]piperidin-4-yl]furan-2-carboxamide?
The canonical SMILES for N-[1-[2-(4-hydroxyphenoxy)propanoyl]piperidin-4-yl]furan-2-carboxamide is CC(Oc1ccc(O)cc1)C(=O)N1CCC(NC(=O)c2ccco2)CC1.
What is the InChIKey of N-[1-[2-(4-hydroxyphenoxy)propanoyl]piperidin-4-yl]furan-2-carboxamide?
The InChIKey is YCEIFCAVSUBYAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O5/c1-13(26-16-6-4-15(22)5-7-16)19(24)21-10-8-14(9-11-21)20-18(23)17-3-2-12-25-17/h2-7,12-14,22H,8-11H2,1H3,(H,20,23).
What are the key properties of N-[1-[2-(4-hydroxyphenoxy)propanoyl]piperidin-4-yl]furan-2-carboxamide?
N-[1-[2-(4-hydroxyphenoxy)propanoyl]piperidin-4-yl]furan-2-carboxamide has a molecular weight of 358.39 g/mol, XLogP of 2.17, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(4-hydroxyphenoxy)propanoyl]piperidin-4-yl]furan-2-carboxamide is sourced from PubChem (CID 108550032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).