N-[3-(2,6-dimethylmorpholin-4-yl)-3-oxopropyl]-N-(2-methoxyethyl)-2-methylfuran-3-carboxamide

C18H28N2O5 — CID 42779884

IUPACN-[3-(2,6-dimethylmorpholin-4-yl)-3-oxopropyl]-N-(2-methoxyethyl)-2-methylfuran-3-carboxamide
SMILESCOCCN(CCC(=O)N1CC(C)OC(C)C1)C(=O)c1ccoc1C
InChIInChI=1S/C18H28N2O5/c1-13-11-20(12-14(2)25-13)17(21)5-7-19(8-10-23-4)18(22)16-6-9-24-15(16)3/h6,9,13-14H,5,7-8,10-12H2,1-4H3
InChIKeyBPYBVCFYVSTWMW-UHFFFAOYSA-N
MW352.43 g/mol
LogP1.70
Rot. Bonds7

About N-[3-(2,6-dimethylmorpholin-4-yl)-3-oxopropyl]-N-(2-methoxyethyl)-2-methylfuran-3-carboxamide

N-[3-(2,6-dimethylmorpholin-4-yl)-3-oxopropyl]-N-(2-methoxyethyl)-2-methylfuran-3-carboxamide (PubChem CID 42779884) has the molecular formula C18H28N2O5 and a molecular weight of 352.43 g/mol. Its IUPAC name is N-[3-(2,6-dimethylmorpholin-4-yl)-3-oxopropyl]-N-(2-methoxyethyl)-2-methylfuran-3-carboxamide.

Molecular Properties

Compound NameN-[3-(2,6-dimethylmorpholin-4-yl)-3-oxopropyl]-N-(2-methoxyethyl)-2-methylfuran-3-carboxamide
PubChem CID42779884
Molecular FormulaC18H28N2O5
Molecular Weight352.43 g/mol
Exact Mass352.20
IUPAC NameN-[3-(2,6-dimethylmorpholin-4-yl)-3-oxopropyl]-N-(2-methoxyethyl)-2-methylfuran-3-carboxamide
SMILESCOCCN(CCC(=O)N1CC(C)OC(C)C1)C(=O)c1ccoc1C
InChIInChI=1S/C18H28N2O5/c1-13-11-20(12-14(2)25-13)17(21)5-7-19(8-10-23-4)18(22)16-6-9-24-15(16)3/h6,9,13-14H,5,7-8,10-12H2,1-4H3
InChIKeyBPYBVCFYVSTWMW-UHFFFAOYSA-N
XLogP1.70
TPSA72.22 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.43
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-oxopropyl]-2-methyl-N-[[(2S)-oxolan-2-yl]methyl]furan-3-carboxamide
CID 6548334
3-[2-methoxyethyl-(2-methylfuran-3-carbonyl)amino]propanoic acid
CID 5103103
N-[3-(tert-butylamino)-3-oxopropyl]-N-(2-methoxyethyl)-2-methylfuran-3-carboxamide
CID 3673721
N-(2-methoxyethyl)-2-methyl-N-[3-oxo-3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]propyl]furan-3-carboxamide
CID 42779894
(2,6-dimethylmorpholin-4-yl)-(2-methylfuran-3-yl)methanone
CID 25236975
N-[3-(2-methoxyethylamino)-3-oxopropyl]-2-methyl-N-propylfuran-3-carboxamide
CID 42779802
N-(2-methoxyethyl)-2-methyl-N-[3-oxo-3-(pyridin-3-ylmethylamino)propyl]furan-3-carboxamide
CID 42779908
N-benzyl-N-[3-(4-ethylpiperazin-1-yl)-3-oxopropyl]-2-methylfuran-3-carboxamide
CID 1030489
methyl 3-[2-methoxyethyl-(3-methylfuran-2-carbonyl)amino]propanoate
CID 78959326
N-[3-(dipropylamino)-3-oxopropyl]-2-methyl-N-(oxolan-2-ylmethyl)furan-3-carboxamide
CID 42780309
N-(2-methoxyethyl)-4-methyl-N-(3-oxo-3-piperazin-1-ylpropyl)benzamide
CID 50779269
(3-hydroxyazetidin-1-yl)-(2-methylfuran-3-yl)methanone
CID 63105467

Frequently Asked Questions

What is the IUPAC name of N-[3-(2,6-dimethylmorpholin-4-yl)-3-oxopropyl]-N-(2-methoxyethyl)-2-methylfuran-3-carboxamide?
The IUPAC name of N-[3-(2,6-dimethylmorpholin-4-yl)-3-oxopropyl]-N-(2-methoxyethyl)-2-methylfuran-3-carboxamide (CID 42779884) is N-[3-(2,6-dimethylmorpholin-4-yl)-3-oxopropyl]-N-(2-methoxyethyl)-2-methylfuran-3-carboxamide.
What is the SMILES notation for N-[3-(2,6-dimethylmorpholin-4-yl)-3-oxopropyl]-N-(2-methoxyethyl)-2-methylfuran-3-carboxamide?
The canonical SMILES for N-[3-(2,6-dimethylmorpholin-4-yl)-3-oxopropyl]-N-(2-methoxyethyl)-2-methylfuran-3-carboxamide is COCCN(CCC(=O)N1CC(C)OC(C)C1)C(=O)c1ccoc1C.
What is the InChIKey of N-[3-(2,6-dimethylmorpholin-4-yl)-3-oxopropyl]-N-(2-methoxyethyl)-2-methylfuran-3-carboxamide?
The InChIKey is BPYBVCFYVSTWMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O5/c1-13-11-20(12-14(2)25-13)17(21)5-7-19(8-10-23-4)18(22)16-6-9-24-15(16)3/h6,9,13-14H,5,7-8,10-12H2,1-4H3.
What are the key properties of N-[3-(2,6-dimethylmorpholin-4-yl)-3-oxopropyl]-N-(2-methoxyethyl)-2-methylfuran-3-carboxamide?
N-[3-(2,6-dimethylmorpholin-4-yl)-3-oxopropyl]-N-(2-methoxyethyl)-2-methylfuran-3-carboxamide has a molecular weight of 352.43 g/mol, XLogP of 1.70, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2,6-dimethylmorpholin-4-yl)-3-oxopropyl]-N-(2-methoxyethyl)-2-methylfuran-3-carboxamide is sourced from PubChem (CID 42779884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).