5-(furan-2-yl)-N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]-1,2-oxazole-3-carboxamide

C21H23N3O4 — CID 47899665

IUPAC5-(furan-2-yl)-N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]-1,2-oxazole-3-carboxamide
SMILESCC1CN(Cc2cccc(CNC(=O)c3cc(-c4ccco4)on3)c2)CCO1
InChIInChI=1S/C21H23N3O4/c1-15-13-24(7-9-26-15)14-17-5-2-4-16(10-17)12-22-21(25)18-11-20(28-23-18)19-6-3-8-27-19/h2-6,8,10-11,15H,7,9,12-14H2,1H3,(H,22,25)
InChIKeyUSYYRGFGEQGURB-UHFFFAOYSA-N
MW381.43 g/mol
LogP3.09
Rot. Bonds6

About 5-(furan-2-yl)-N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]-1,2-oxazole-3-carboxamide

5-(furan-2-yl)-N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]-1,2-oxazole-3-carboxamide (PubChem CID 47899665) has the molecular formula C21H23N3O4 and a molecular weight of 381.43 g/mol. Its IUPAC name is 5-(furan-2-yl)-N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-(furan-2-yl)-N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]-1,2-oxazole-3-carboxamide
PubChem CID47899665
Molecular FormulaC21H23N3O4
Molecular Weight381.43 g/mol
Exact Mass381.17
IUPAC Name5-(furan-2-yl)-N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]-1,2-oxazole-3-carboxamide
SMILESCC1CN(Cc2cccc(CNC(=O)c3cc(-c4ccco4)on3)c2)CCO1
InChIInChI=1S/C21H23N3O4/c1-15-13-24(7-9-26-15)14-17-5-2-4-16(10-17)12-22-21(25)18-11-20(28-23-18)19-6-3-8-27-19/h2-6,8,10-11,15H,7,9,12-14H2,1H3,(H,22,25)
InChIKeyUSYYRGFGEQGURB-UHFFFAOYSA-N
XLogP3.09
TPSA80.74 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.43
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-(furan-2-yl)-N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]-1,2-oxazole-3-carboxamide with MolForge

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Related Compounds

2-amino-2-methyl-N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]propanamide;dihydrochloride
CID 119864244
1-[[3-[[(2S)-2-methylmorpholin-4-yl]methyl]phenyl]methyl]-3-(5-methyl-1,3,4-thiadiazol-2-yl)urea
CID 52509866
(Z)-2-methyl-N-[[3-[[(2R)-2-methylmorpholin-4-yl]methyl]phenyl]methyl]pent-2-enamide
CID 94820446
1-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]-3-phenylurea
CID 60586672
1-[[3-[[(2S)-2-methylmorpholin-4-yl]methyl]phenyl]methyl]-3-[[(2R)-oxolan-2-yl]methyl]urea
CID 124839884
N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]ethanamine
CID 62439094
N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]-2-(2-nitrophenyl)acetamide
CID 47900135
N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]tetrazolo[1,5-a]pyridine-8-carboxamide
CID 166252634
4,4-dimethyl-N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]pent-2-enamide
CID 72689925
N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]-2-(4-sulfamoylphenyl)acetamide
CID 56552754
5-methyl-N-[2-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methylamino]-2-oxoethyl]thiophene-2-carboxamide
CID 47900151
N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]pyrrolidine-3-carboxamide
CID 119864301

Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)-N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-(furan-2-yl)-N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]-1,2-oxazole-3-carboxamide (CID 47899665) is 5-(furan-2-yl)-N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-(furan-2-yl)-N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-(furan-2-yl)-N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]-1,2-oxazole-3-carboxamide is CC1CN(Cc2cccc(CNC(=O)c3cc(-c4ccco4)on3)c2)CCO1.
What is the InChIKey of 5-(furan-2-yl)-N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]-1,2-oxazole-3-carboxamide?
The InChIKey is USYYRGFGEQGURB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O4/c1-15-13-24(7-9-26-15)14-17-5-2-4-16(10-17)12-22-21(25)18-11-20(28-23-18)19-6-3-8-27-19/h2-6,8,10-11,15H,7,9,12-14H2,1H3,(H,22,25).
What are the key properties of 5-(furan-2-yl)-N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]-1,2-oxazole-3-carboxamide?
5-(furan-2-yl)-N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]-1,2-oxazole-3-carboxamide has a molecular weight of 381.43 g/mol, XLogP of 3.09, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-yl)-N-[[3-[(2-methylmorpholin-4-yl)methyl]phenyl]methyl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 47899665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).