5-[(4-methoxyphenoxy)methyl]-N-[3-(morpholin-4-ylmethyl)phenyl]furan-2-carboxamide

C24H26N2O5 — CID 19451164

IUPAC5-[(4-methoxyphenoxy)methyl]-N-[3-(morpholin-4-ylmethyl)phenyl]furan-2-carboxamide
SMILESCOc1ccc(OCc2ccc(C(=O)Nc3cccc(CN4CCOCC4)c3)o2)cc1
InChIInChI=1S/C24H26N2O5/c1-28-20-5-7-21(8-6-20)30-17-22-9-10-23(31-22)24(27)25-19-4-2-3-18(15-19)16-26-11-13-29-14-12-26/h2-10,15H,11-14,16-17H2,1H3,(H,25,27)
InChIKeyIVMFCRVDMWNXGF-UHFFFAOYSA-N
MW422.48 g/mol
LogP3.95
Rot. Bonds8

About 5-[(4-methoxyphenoxy)methyl]-N-[3-(morpholin-4-ylmethyl)phenyl]furan-2-carboxamide

5-[(4-methoxyphenoxy)methyl]-N-[3-(morpholin-4-ylmethyl)phenyl]furan-2-carboxamide (PubChem CID 19451164) has the molecular formula C24H26N2O5 and a molecular weight of 422.48 g/mol. Its IUPAC name is 5-[(4-methoxyphenoxy)methyl]-N-[3-(morpholin-4-ylmethyl)phenyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-[(4-methoxyphenoxy)methyl]-N-[3-(morpholin-4-ylmethyl)phenyl]furan-2-carboxamide
PubChem CID19451164
Molecular FormulaC24H26N2O5
Molecular Weight422.48 g/mol
Exact Mass422.18
IUPAC Name5-[(4-methoxyphenoxy)methyl]-N-[3-(morpholin-4-ylmethyl)phenyl]furan-2-carboxamide
SMILESCOc1ccc(OCc2ccc(C(=O)Nc3cccc(CN4CCOCC4)c3)o2)cc1
InChIInChI=1S/C24H26N2O5/c1-28-20-5-7-21(8-6-20)30-17-22-9-10-23(31-22)24(27)25-19-4-2-3-18(15-19)16-26-11-13-29-14-12-26/h2-10,15H,11-14,16-17H2,1H3,(H,25,27)
InChIKeyIVMFCRVDMWNXGF-UHFFFAOYSA-N
XLogP3.95
TPSA73.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms31
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.48
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-[(4-methoxyphenoxy)methyl]-N-[3-(morpholin-4-ylmethyl)phenyl]furan-2-carboxamide?
The IUPAC name of 5-[(4-methoxyphenoxy)methyl]-N-[3-(morpholin-4-ylmethyl)phenyl]furan-2-carboxamide (CID 19451164) is 5-[(4-methoxyphenoxy)methyl]-N-[3-(morpholin-4-ylmethyl)phenyl]furan-2-carboxamide.
What is the SMILES notation for 5-[(4-methoxyphenoxy)methyl]-N-[3-(morpholin-4-ylmethyl)phenyl]furan-2-carboxamide?
The canonical SMILES for 5-[(4-methoxyphenoxy)methyl]-N-[3-(morpholin-4-ylmethyl)phenyl]furan-2-carboxamide is COc1ccc(OCc2ccc(C(=O)Nc3cccc(CN4CCOCC4)c3)o2)cc1.
What is the InChIKey of 5-[(4-methoxyphenoxy)methyl]-N-[3-(morpholin-4-ylmethyl)phenyl]furan-2-carboxamide?
The InChIKey is IVMFCRVDMWNXGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O5/c1-28-20-5-7-21(8-6-20)30-17-22-9-10-23(31-22)24(27)25-19-4-2-3-18(15-19)16-26-11-13-29-14-12-26/h2-10,15H,11-14,16-17H2,1H3,(H,25,27).
What are the key properties of 5-[(4-methoxyphenoxy)methyl]-N-[3-(morpholin-4-ylmethyl)phenyl]furan-2-carboxamide?
5-[(4-methoxyphenoxy)methyl]-N-[3-(morpholin-4-ylmethyl)phenyl]furan-2-carboxamide has a molecular weight of 422.48 g/mol, XLogP of 3.95, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-methoxyphenoxy)methyl]-N-[3-(morpholin-4-ylmethyl)phenyl]furan-2-carboxamide is sourced from PubChem (CID 19451164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).