2-(2,4-dimethylphenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide

C21H28N2O4 — CID 18164117

IUPAC2-(2,4-dimethylphenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide
SMILESCc1ccc(OCC(=O)NCC(c2ccc(C)o2)N2CCOCC2)c(C)c1
InChIInChI=1S/C21H28N2O4/c1-15-4-6-19(16(2)12-15)26-14-21(24)22-13-18(20-7-5-17(3)27-20)23-8-10-25-11-9-23/h4-7,12,18H,8-11,13-14H2,1-3H3,(H,22,24)
InChIKeyXYYZUDVXZKMWAK-UHFFFAOYSA-N
MW372.47 g/mol
LogP2.77
Rot. Bonds7

About 2-(2,4-dimethylphenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide

2-(2,4-dimethylphenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide (PubChem CID 18164117) has the molecular formula C21H28N2O4 and a molecular weight of 372.47 g/mol. Its IUPAC name is 2-(2,4-dimethylphenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dimethylphenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide
PubChem CID18164117
Molecular FormulaC21H28N2O4
Molecular Weight372.47 g/mol
Exact Mass372.20
IUPAC Name2-(2,4-dimethylphenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide
SMILESCc1ccc(OCC(=O)NCC(c2ccc(C)o2)N2CCOCC2)c(C)c1
InChIInChI=1S/C21H28N2O4/c1-15-4-6-19(16(2)12-15)26-14-21(24)22-13-18(20-7-5-17(3)27-20)23-8-10-25-11-9-23/h4-7,12,18H,8-11,13-14H2,1-3H3,(H,22,24)
InChIKeyXYYZUDVXZKMWAK-UHFFFAOYSA-N
XLogP2.77
TPSA63.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-chloro-5-methylphenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide
CID 18164100
2-(2,5-dichlorophenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide
CID 18164234
2-(2,4-dimethylphenoxy)-N-(3-methyl-2-morpholin-4-ylbutyl)acetamide
CID 43067301
N-[(2S)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-naphthalen-1-yloxyacetamide
CID 26006499
2-(4-fluorophenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide
CID 18164114
2-(3-fluorophenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide
CID 18164161
2-(3-chlorophenoxy)-N-[(2S)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide
CID 51927031
N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-[(2-phenoxyacetyl)amino]acetamide
CID 32707918
2-amino-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide
CID 119837790
2-(methylamino)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide
CID 120703417
3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]butanamide
CID 51283060
N-[(2S)-2-(5-methylfuran-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2-(2-methylphenoxy)acetamide
CID 26834793

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylphenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide?
The IUPAC name of 2-(2,4-dimethylphenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide (CID 18164117) is 2-(2,4-dimethylphenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide.
What is the SMILES notation for 2-(2,4-dimethylphenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide?
The canonical SMILES for 2-(2,4-dimethylphenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide is Cc1ccc(OCC(=O)NCC(c2ccc(C)o2)N2CCOCC2)c(C)c1.
What is the InChIKey of 2-(2,4-dimethylphenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide?
The InChIKey is XYYZUDVXZKMWAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N2O4/c1-15-4-6-19(16(2)12-15)26-14-21(24)22-13-18(20-7-5-17(3)27-20)23-8-10-25-11-9-23/h4-7,12,18H,8-11,13-14H2,1-3H3,(H,22,24).
What are the key properties of 2-(2,4-dimethylphenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide?
2-(2,4-dimethylphenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide has a molecular weight of 372.47 g/mol, XLogP of 2.77, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylphenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide is sourced from PubChem (CID 18164117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).