N-[(5-methylfuran-2-yl)methyl]-2-[2-oxo-2-[4-(2-phenylethoxy)anilino]ethoxy]acetamide

C24H26N2O5 — CID 5195228

IUPACN-[(5-methylfuran-2-yl)methyl]-2-[2-oxo-2-[4-(2-phenylethoxy)anilino]ethoxy]acetamide
SMILESCc1ccc(CNC(=O)COCC(=O)Nc2ccc(OCCc3ccccc3)cc2)o1
InChIInChI=1S/C24H26N2O5/c1-18-7-10-22(31-18)15-25-23(27)16-29-17-24(28)26-20-8-11-21(12-9-20)30-14-13-19-5-3-2-4-6-19/h2-12H,13-17H2,1H3,(H,25,27)(H,26,28)
InChIKeyAEAPQJFEKRMKLB-UHFFFAOYSA-N
MW422.48 g/mol
LogP3.48
Rot. Bonds11

About N-[(5-methylfuran-2-yl)methyl]-2-[2-oxo-2-[4-(2-phenylethoxy)anilino]ethoxy]acetamide

N-[(5-methylfuran-2-yl)methyl]-2-[2-oxo-2-[4-(2-phenylethoxy)anilino]ethoxy]acetamide (PubChem CID 5195228) has the molecular formula C24H26N2O5 and a molecular weight of 422.48 g/mol. Its IUPAC name is N-[(5-methylfuran-2-yl)methyl]-2-[2-oxo-2-[4-(2-phenylethoxy)anilino]ethoxy]acetamide.

Molecular Properties

Compound NameN-[(5-methylfuran-2-yl)methyl]-2-[2-oxo-2-[4-(2-phenylethoxy)anilino]ethoxy]acetamide
PubChem CID5195228
Molecular FormulaC24H26N2O5
Molecular Weight422.48 g/mol
Exact Mass422.18
IUPAC NameN-[(5-methylfuran-2-yl)methyl]-2-[2-oxo-2-[4-(2-phenylethoxy)anilino]ethoxy]acetamide
SMILESCc1ccc(CNC(=O)COCC(=O)Nc2ccc(OCCc3ccccc3)cc2)o1
InChIInChI=1S/C24H26N2O5/c1-18-7-10-22(31-18)15-25-23(27)16-29-17-24(28)26-20-8-11-21(12-9-20)30-14-13-19-5-3-2-4-6-19/h2-12H,13-17H2,1H3,(H,25,27)(H,26,28)
InChIKeyAEAPQJFEKRMKLB-UHFFFAOYSA-N
XLogP3.48
TPSA89.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.48
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-oxo-2-[4-(2-phenylethoxy)anilino]ethoxy]-N-(thiophen-2-ylmethyl)acetamide
CID 3889056
2-[2-oxo-2-[4-(2-phenylethoxy)anilino]ethoxy]acetate
CID 7320451
2-[2-(3-chloro-4-methylanilino)-2-oxoethoxy]-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 4575448
3-phenyl-N-[4-(2-phenylethoxy)phenyl]propanamide
CID 17066904
N-(4-methylphenyl)-2-[4-(2-phenylethoxy)anilino]acetamide
CID 54824064
N-[4-(2-phenylethoxy)phenyl]-2-(4-propan-2-yloxyanilino)acetamide
CID 54822610
2-(2,6-dimethylphenoxy)-N-[4-(3-phenylpropoxy)phenyl]acetamide
CID 17130083
N,N'-bis[4-(2-phenylethoxy)phenyl]nonanediamide
CID 17067257
2-(4-ethoxyanilino)-N-[4-(2-phenylethoxy)phenyl]acetamide
CID 54811684
2-[4-(2-methoxyethoxy)anilino]-N-[4-(2-phenylethoxy)phenyl]acetamide
CID 54822166
N-[4-(2-phenylethoxy)phenyl]-2-(propylamino)acetamide
CID 54818682
2-[4-(aminomethyl)phenoxy]-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 62525022

Frequently Asked Questions

What is the IUPAC name of N-[(5-methylfuran-2-yl)methyl]-2-[2-oxo-2-[4-(2-phenylethoxy)anilino]ethoxy]acetamide?
The IUPAC name of N-[(5-methylfuran-2-yl)methyl]-2-[2-oxo-2-[4-(2-phenylethoxy)anilino]ethoxy]acetamide (CID 5195228) is N-[(5-methylfuran-2-yl)methyl]-2-[2-oxo-2-[4-(2-phenylethoxy)anilino]ethoxy]acetamide.
What is the SMILES notation for N-[(5-methylfuran-2-yl)methyl]-2-[2-oxo-2-[4-(2-phenylethoxy)anilino]ethoxy]acetamide?
The canonical SMILES for N-[(5-methylfuran-2-yl)methyl]-2-[2-oxo-2-[4-(2-phenylethoxy)anilino]ethoxy]acetamide is Cc1ccc(CNC(=O)COCC(=O)Nc2ccc(OCCc3ccccc3)cc2)o1.
What is the InChIKey of N-[(5-methylfuran-2-yl)methyl]-2-[2-oxo-2-[4-(2-phenylethoxy)anilino]ethoxy]acetamide?
The InChIKey is AEAPQJFEKRMKLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O5/c1-18-7-10-22(31-18)15-25-23(27)16-29-17-24(28)26-20-8-11-21(12-9-20)30-14-13-19-5-3-2-4-6-19/h2-12H,13-17H2,1H3,(H,25,27)(H,26,28).
What are the key properties of N-[(5-methylfuran-2-yl)methyl]-2-[2-oxo-2-[4-(2-phenylethoxy)anilino]ethoxy]acetamide?
N-[(5-methylfuran-2-yl)methyl]-2-[2-oxo-2-[4-(2-phenylethoxy)anilino]ethoxy]acetamide has a molecular weight of 422.48 g/mol, XLogP of 3.48, 11 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methylfuran-2-yl)methyl]-2-[2-oxo-2-[4-(2-phenylethoxy)anilino]ethoxy]acetamide is sourced from PubChem (CID 5195228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).