N,N-bis(furan-2-ylmethyl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide

C22H25NO4 — CID 112767079

IUPACN,N-bis(furan-2-ylmethyl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide
SMILESCc1ccc(C(C)C)c(OCC(=O)N(Cc2ccco2)Cc2ccco2)c1
InChIInChI=1S/C22H25NO4/c1-16(2)20-9-8-17(3)12-21(20)27-15-22(24)23(13-18-6-4-10-25-18)14-19-7-5-11-26-19/h4-12,16H,13-15H2,1-3H3
InChIKeyLBCWYSQERMTKGM-UHFFFAOYSA-N
MW367.45 g/mol
LogP4.91
Rot. Bonds8

About N,N-bis(furan-2-ylmethyl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide

N,N-bis(furan-2-ylmethyl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide (PubChem CID 112767079) has the molecular formula C22H25NO4 and a molecular weight of 367.45 g/mol. Its IUPAC name is N,N-bis(furan-2-ylmethyl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide.

Molecular Properties

Compound NameN,N-bis(furan-2-ylmethyl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide
PubChem CID112767079
Molecular FormulaC22H25NO4
Molecular Weight367.45 g/mol
Exact Mass367.18
IUPAC NameN,N-bis(furan-2-ylmethyl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide
SMILESCc1ccc(C(C)C)c(OCC(=O)N(Cc2ccco2)Cc2ccco2)c1
InChIInChI=1S/C22H25NO4/c1-16(2)20-9-8-17(3)12-21(20)27-15-22(24)23(13-18-6-4-10-25-18)14-19-7-5-11-26-19/h4-12,16H,13-15H2,1-3H3
InChIKeyLBCWYSQERMTKGM-UHFFFAOYSA-N
XLogP4.91
TPSA55.82 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 54.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(5-methyl-2-propan-2-ylphenoxy)acetamide
CID 112790561
N-methyl-2-(5-methyl-2-propan-2-ylphenoxy)-N-propan-2-ylacetamide
CID 86907722
N,N-bis(furan-2-ylmethyl)-2-propan-2-yloxyacetamide
CID 115593503
N-benzyl-2-(3,5-dimethylphenoxy)-N-(furan-2-ylmethyl)acetamide
CID 18830858
N-(furan-2-ylmethyl)-2-(2-methoxy-4-methylphenoxy)-N-(4-methylphenyl)acetamide
CID 31964022
2-(5-methyl-2-propan-2-ylphenoxy)acetamide
CID 681895
1-(furan-2-ylmethylamino)-3-(5-methyl-2-propan-2-ylphenoxy)propan-2-ol;oxalic acid
CID 18593406
2-(2-aminophenoxy)-N-ethyl-N-(furan-2-ylmethyl)acetamide
CID 61110180
(2R)-1-(furan-2-ylmethylamino)-3-(5-methyl-2-propan-2-ylphenoxy)propan-2-ol
CID 41300568
propan-2-yl 2-(5-methyl-2-propan-2-ylphenoxy)acetate
CID 54941393
N-benzyl-2-(4-ethoxyphenoxy)-N-(furan-2-ylmethyl)acetamide
CID 99141396
N,N-dimethyl-2-[5-methyl-2-[1-(methylamino)ethyl]phenoxy]acetamide
CID 63639445

Frequently Asked Questions

What is the IUPAC name of N,N-bis(furan-2-ylmethyl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide?
The IUPAC name of N,N-bis(furan-2-ylmethyl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide (CID 112767079) is N,N-bis(furan-2-ylmethyl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide.
What is the SMILES notation for N,N-bis(furan-2-ylmethyl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide?
The canonical SMILES for N,N-bis(furan-2-ylmethyl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide is Cc1ccc(C(C)C)c(OCC(=O)N(Cc2ccco2)Cc2ccco2)c1.
What is the InChIKey of N,N-bis(furan-2-ylmethyl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide?
The InChIKey is LBCWYSQERMTKGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25NO4/c1-16(2)20-9-8-17(3)12-21(20)27-15-22(24)23(13-18-6-4-10-25-18)14-19-7-5-11-26-19/h4-12,16H,13-15H2,1-3H3.
What are the key properties of N,N-bis(furan-2-ylmethyl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide?
N,N-bis(furan-2-ylmethyl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide has a molecular weight of 367.45 g/mol, XLogP of 4.91, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(furan-2-ylmethyl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide is sourced from PubChem (CID 112767079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).