5-cyclopropyl-N-[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1,2-oxazole-3-carboxamide

C20H25N3O4 — CID 32911137

IUPAC5-cyclopropyl-N-[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1,2-oxazole-3-carboxamide
SMILESCOc1ccc([C@@H](CNC(=O)c2cc(C3CC3)on2)N2CCOCC2)cc1
InChIInChI=1S/C20H25N3O4/c1-25-16-6-4-14(5-7-16)18(23-8-10-26-11-9-23)13-21-20(24)17-12-19(27-22-17)15-2-3-15/h4-7,12,15,18H,2-3,8-11,13H2,1H3,(H,21,24)/t18-/m1/s1
InChIKeyYSPGNMNBAGULJC-GOSISDBHSA-N
MW371.44 g/mol
LogP2.36
Rot. Bonds7

About 5-cyclopropyl-N-[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1,2-oxazole-3-carboxamide

5-cyclopropyl-N-[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1,2-oxazole-3-carboxamide (PubChem CID 32911137) has the molecular formula C20H25N3O4 and a molecular weight of 371.44 g/mol. Its IUPAC name is 5-cyclopropyl-N-[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1,2-oxazole-3-carboxamide
PubChem CID32911137
Molecular FormulaC20H25N3O4
Molecular Weight371.44 g/mol
Exact Mass371.18
IUPAC Name5-cyclopropyl-N-[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1,2-oxazole-3-carboxamide
SMILESCOc1ccc([C@@H](CNC(=O)c2cc(C3CC3)on2)N2CCOCC2)cc1
InChIInChI=1S/C20H25N3O4/c1-25-16-6-4-14(5-7-16)18(23-8-10-26-11-9-23)13-21-20(24)17-12-19(27-22-17)15-2-3-15/h4-7,12,15,18H,2-3,8-11,13H2,1H3,(H,21,24)/t18-/m1/s1
InChIKeyYSPGNMNBAGULJC-GOSISDBHSA-N
XLogP2.36
TPSA76.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-(4-methoxyphenyl)-N-[2-morpholin-4-yl-2-(4-propan-2-ylphenyl)ethyl]-1,2-oxazole-3-carboxamide
CID 45132937
5-cyclopropyl-N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]-1,2-oxazole-3-carboxamide
CID 95129634
N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide
CID 119039670
N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-5-methyl-1-phenylpyrazole-3-carboxamide
CID 55754690
4-methoxy-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 31460518
4-methoxy-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 17011129
N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-2,5-dimethylfuran-3-carboxamide
CID 2998590
N-[(2R)-2-(4-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 42272190
N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]propanamide
CID 43006637
N-[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-N'-(5-methyl-1,2-oxazol-3-yl)oxamide
CID 30835539
N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-4-methoxybenzamide
CID 30834690
N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]cyclohexanecarboxamide
CID 16811484

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-cyclopropyl-N-[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1,2-oxazole-3-carboxamide (CID 32911137) is 5-cyclopropyl-N-[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1,2-oxazole-3-carboxamide is COc1ccc([C@@H](CNC(=O)c2cc(C3CC3)on2)N2CCOCC2)cc1.
What is the InChIKey of 5-cyclopropyl-N-[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1,2-oxazole-3-carboxamide?
The InChIKey is YSPGNMNBAGULJC-GOSISDBHSA-N. The full InChI is InChI=1S/C20H25N3O4/c1-25-16-6-4-14(5-7-16)18(23-8-10-26-11-9-23)13-21-20(24)17-12-19(27-22-17)15-2-3-15/h4-7,12,15,18H,2-3,8-11,13H2,1H3,(H,21,24)/t18-/m1/s1.
What are the key properties of 5-cyclopropyl-N-[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1,2-oxazole-3-carboxamide?
5-cyclopropyl-N-[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1,2-oxazole-3-carboxamide has a molecular weight of 371.44 g/mol, XLogP of 2.36, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 32911137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).