N-[(4-ethoxyphenyl)methyl]-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide

C19H25N3O4 — CID 46341215

IUPACN-[(4-ethoxyphenyl)methyl]-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide
SMILESCCOc1ccc(CNC(=O)c2noc(C)c2CN2CCOCC2)cc1
InChIInChI=1S/C19H25N3O4/c1-3-25-16-6-4-15(5-7-16)12-20-19(23)18-17(14(2)26-21-18)13-22-8-10-24-11-9-22/h4-7H,3,8-13H2,1-2H3,(H,20,23)
InChIKeyZKRISAXDDXWKMB-UHFFFAOYSA-N
MW359.43 g/mol
LogP2.14
Rot. Bonds7

About N-[(4-ethoxyphenyl)methyl]-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide

N-[(4-ethoxyphenyl)methyl]-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide (PubChem CID 46341215) has the molecular formula C19H25N3O4 and a molecular weight of 359.43 g/mol. Its IUPAC name is N-[(4-ethoxyphenyl)methyl]-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-[(4-ethoxyphenyl)methyl]-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide
PubChem CID46341215
Molecular FormulaC19H25N3O4
Molecular Weight359.43 g/mol
Exact Mass359.18
IUPAC NameN-[(4-ethoxyphenyl)methyl]-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide
SMILESCCOc1ccc(CNC(=O)c2noc(C)c2CN2CCOCC2)cc1
InChIInChI=1S/C19H25N3O4/c1-3-25-16-6-4-15(5-7-16)12-20-19(23)18-17(14(2)26-21-18)13-22-8-10-24-11-9-22/h4-7H,3,8-13H2,1-2H3,(H,20,23)
InChIKeyZKRISAXDDXWKMB-UHFFFAOYSA-N
XLogP2.14
TPSA76.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N'-[(4-ethoxyphenyl)methyl]-N-(3-morpholin-4-ylpropyl)oxamide
CID 125145042
4-[(4-fluorophenoxy)methyl]-N-[(4-fluorophenyl)methyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 19445267
N-[2-(4-ethoxyphenyl)ethyl]-5-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide
CID 20950937
2-(4-ethoxyphenyl)-N-[(4-morpholin-4-ylphenyl)methyl]acetamide
CID 28784276
5-methyl-4-(morpholin-4-ylmethyl)-N-[(2R)-4-phenylbutan-2-yl]-1,2-oxazole-3-carboxamide
CID 92724963
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[(4-methoxyphenyl)methyl]piperazine-1-carboxamide
CID 75527445
N-[(4-ethoxyphenyl)methyl]-4-[(4-methylpiperidin-1-yl)methyl]benzamide
CID 53283400
N,N'-bis[(4-ethoxyphenyl)methyl]oxamide
CID 125144939
4-ethoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]carbamothioyl]benzamide
CID 979170
[1-[(4-ethoxyphenyl)methyl]piperidin-4-yl]-morpholin-4-ylmethanone
CID 883926
N-[(Z)-1-(4-ethoxyphenyl)ethylideneamino]-4-(morpholin-4-ylmethyl)benzamide
CID 6156574
4-ethoxy-N-[[4-[[(4-ethoxybenzoyl)amino]methyl]phenyl]methyl]benzamide
CID 3528873

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethoxyphenyl)methyl]-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N-[(4-ethoxyphenyl)methyl]-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide (CID 46341215) is N-[(4-ethoxyphenyl)methyl]-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-[(4-ethoxyphenyl)methyl]-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-[(4-ethoxyphenyl)methyl]-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide is CCOc1ccc(CNC(=O)c2noc(C)c2CN2CCOCC2)cc1.
What is the InChIKey of N-[(4-ethoxyphenyl)methyl]-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide?
The InChIKey is ZKRISAXDDXWKMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O4/c1-3-25-16-6-4-15(5-7-16)12-20-19(23)18-17(14(2)26-21-18)13-22-8-10-24-11-9-22/h4-7H,3,8-13H2,1-2H3,(H,20,23).
What are the key properties of N-[(4-ethoxyphenyl)methyl]-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide?
N-[(4-ethoxyphenyl)methyl]-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide has a molecular weight of 359.43 g/mol, XLogP of 2.14, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethoxyphenyl)methyl]-5-methyl-4-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 46341215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).