3-(3,4-difluorophenyl)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]propanamide

C20H24F2N2O3 — CID 46546938

IUPAC3-(3,4-difluorophenyl)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]propanamide
SMILESCc1ccc(C(CNC(=O)CCc2ccc(F)c(F)c2)N2CCOCC2)o1
InChIInChI=1S/C20H24F2N2O3/c1-14-2-6-19(27-14)18(24-8-10-26-11-9-24)13-23-20(25)7-4-15-3-5-16(21)17(22)12-15/h2-3,5-6,12,18H,4,7-11,13H2,1H3,(H,23,25)
InChIKeyVIJRUZWULFZVRK-UHFFFAOYSA-N
MW378.42 g/mol
LogP2.99
Rot. Bonds7

About 3-(3,4-difluorophenyl)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]propanamide

3-(3,4-difluorophenyl)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]propanamide (PubChem CID 46546938) has the molecular formula C20H24F2N2O3 and a molecular weight of 378.42 g/mol. Its IUPAC name is 3-(3,4-difluorophenyl)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]propanamide.

Molecular Properties

Compound Name3-(3,4-difluorophenyl)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]propanamide
PubChem CID46546938
Molecular FormulaC20H24F2N2O3
Molecular Weight378.42 g/mol
Exact Mass378.18
IUPAC Name3-(3,4-difluorophenyl)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]propanamide
SMILESCc1ccc(C(CNC(=O)CCc2ccc(F)c(F)c2)N2CCOCC2)o1
InChIInChI=1S/C20H24F2N2O3/c1-14-2-6-19(27-14)18(24-8-10-26-11-9-24)13-23-20(25)7-4-15-3-5-16(21)17(22)12-15/h2-3,5-6,12,18H,4,7-11,13H2,1H3,(H,23,25)
InChIKeyVIJRUZWULFZVRK-UHFFFAOYSA-N
XLogP2.99
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.42
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3-chloro-4-methylphenyl)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]propanamide
CID 24643835
2-amino-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide
CID 119837790
N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-(4-methyl-1,2,4-triazol-3-yl)propanamide
CID 74233266
2-(4-fluorophenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide
CID 18164114
3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]butanamide
CID 51283060
2-(methylamino)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide
CID 120703417
3-(methanesulfonamido)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]propanamide
CID 118763137
N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-4-oxo-4-phenylbutanamide
CID 51283099
4-(3,4-dimethylphenyl)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-4-oxobutanamide
CID 24643824
2-(2,5-dichlorophenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide
CID 18164234
2-(3-fluorophenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide
CID 18164161
N-[(2S)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-phenoxypropanamide
CID 95577240

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-difluorophenyl)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]propanamide?
The IUPAC name of 3-(3,4-difluorophenyl)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]propanamide (CID 46546938) is 3-(3,4-difluorophenyl)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]propanamide.
What is the SMILES notation for 3-(3,4-difluorophenyl)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]propanamide?
The canonical SMILES for 3-(3,4-difluorophenyl)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]propanamide is Cc1ccc(C(CNC(=O)CCc2ccc(F)c(F)c2)N2CCOCC2)o1.
What is the InChIKey of 3-(3,4-difluorophenyl)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]propanamide?
The InChIKey is VIJRUZWULFZVRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24F2N2O3/c1-14-2-6-19(27-14)18(24-8-10-26-11-9-24)13-23-20(25)7-4-15-3-5-16(21)17(22)12-15/h2-3,5-6,12,18H,4,7-11,13H2,1H3,(H,23,25).
What are the key properties of 3-(3,4-difluorophenyl)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]propanamide?
3-(3,4-difluorophenyl)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]propanamide has a molecular weight of 378.42 g/mol, XLogP of 2.99, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-difluorophenyl)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]propanamide is sourced from PubChem (CID 46546938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).