N-ethyl-3-methoxy-N-[1-(1-phenylethyl)pyrrolidin-3-yl]-1,2-oxazole-5-carboxamide

C19H25N3O3 — CID 75507595

IUPACN-ethyl-3-methoxy-N-[1-(1-phenylethyl)pyrrolidin-3-yl]-1,2-oxazole-5-carboxamide
SMILESCCN(C(=O)c1cc(OC)no1)C1CCN(C(C)c2ccccc2)C1
InChIInChI=1S/C19H25N3O3/c1-4-22(19(23)17-12-18(24-3)20-25-17)16-10-11-21(13-16)14(2)15-8-6-5-7-9-15/h5-9,12,14,16H,4,10-11,13H2,1-3H3
InChIKeyMTFLBTVXQZFYGK-UHFFFAOYSA-N
MW343.43 g/mol
LogP2.98
Rot. Bonds6

About N-ethyl-3-methoxy-N-[1-(1-phenylethyl)pyrrolidin-3-yl]-1,2-oxazole-5-carboxamide

N-ethyl-3-methoxy-N-[1-(1-phenylethyl)pyrrolidin-3-yl]-1,2-oxazole-5-carboxamide (PubChem CID 75507595) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is N-ethyl-3-methoxy-N-[1-(1-phenylethyl)pyrrolidin-3-yl]-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-ethyl-3-methoxy-N-[1-(1-phenylethyl)pyrrolidin-3-yl]-1,2-oxazole-5-carboxamide
PubChem CID75507595
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC NameN-ethyl-3-methoxy-N-[1-(1-phenylethyl)pyrrolidin-3-yl]-1,2-oxazole-5-carboxamide
SMILESCCN(C(=O)c1cc(OC)no1)C1CCN(C(C)c2ccccc2)C1
InChIInChI=1S/C19H25N3O3/c1-4-22(19(23)17-12-18(24-3)20-25-17)16-10-11-21(13-16)14(2)15-8-6-5-7-9-15/h5-9,12,14,16H,4,10-11,13H2,1-3H3
InChIKeyMTFLBTVXQZFYGK-UHFFFAOYSA-N
XLogP2.98
TPSA58.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-3-methyl-N-[(3R)-1-[(1S)-1-phenylethyl]pyrrolidin-3-yl]-1,2-oxazole-5-carboxamide
CID 94811047
N-ethyl-5-methyl-N-[(3S)-1-[(1S)-1-phenylethyl]pyrrolidin-3-yl]-1,2-oxazole-3-carboxamide
CID 95286765
4-bromo-N-ethyl-3,5-dimethoxy-N-[(3S)-1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]benzamide
CID 98691639
N-ethyl-N-[1-(1-phenylethyl)pyrrolidin-3-yl]acetamide
CID 51091141
N-ethyl-2-methoxy-N-[(3R)-1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]acetamide
CID 98753200
1-ethyl-3-(5-methyl-1,2-oxazol-3-yl)-1-[(3S)-1-[(1S)-1-phenylethyl]pyrrolidin-3-yl]urea
CID 96529450
N-ethyl-N-[1-(1-phenylethyl)pyrrolidin-3-yl]quinoline-6-carboxamide
CID 86874699
N-ethyl-N-[(3R)-1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]-3-sulfamoylbenzamide
CID 98728365
(2S)-N-ethyl-2-(2-methylpropoxy)-N-[(3R)-1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]propanamide
CID 98728361
5-[(4-cyanophenoxy)methyl]-N-ethyl-N-[1-(1-phenylethyl)pyrrolidin-3-yl]furan-2-carboxamide
CID 86886728
N-[4-[[ethyl-[(3S)-1-[(1S)-1-phenylethyl]pyrrolidin-3-yl]carbamoyl]amino]-2-methoxyphenyl]acetamide
CID 96537032
N-ethyl-3-[methyl(phenyl)sulfamoyl]-N-[(3S)-1-[(1S)-1-phenylethyl]pyrrolidin-3-yl]benzamide
CID 52908504

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-methoxy-N-[1-(1-phenylethyl)pyrrolidin-3-yl]-1,2-oxazole-5-carboxamide?
The IUPAC name of N-ethyl-3-methoxy-N-[1-(1-phenylethyl)pyrrolidin-3-yl]-1,2-oxazole-5-carboxamide (CID 75507595) is N-ethyl-3-methoxy-N-[1-(1-phenylethyl)pyrrolidin-3-yl]-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N-ethyl-3-methoxy-N-[1-(1-phenylethyl)pyrrolidin-3-yl]-1,2-oxazole-5-carboxamide?
The canonical SMILES for N-ethyl-3-methoxy-N-[1-(1-phenylethyl)pyrrolidin-3-yl]-1,2-oxazole-5-carboxamide is CCN(C(=O)c1cc(OC)no1)C1CCN(C(C)c2ccccc2)C1.
What is the InChIKey of N-ethyl-3-methoxy-N-[1-(1-phenylethyl)pyrrolidin-3-yl]-1,2-oxazole-5-carboxamide?
The InChIKey is MTFLBTVXQZFYGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-4-22(19(23)17-12-18(24-3)20-25-17)16-10-11-21(13-16)14(2)15-8-6-5-7-9-15/h5-9,12,14,16H,4,10-11,13H2,1-3H3.
What are the key properties of N-ethyl-3-methoxy-N-[1-(1-phenylethyl)pyrrolidin-3-yl]-1,2-oxazole-5-carboxamide?
N-ethyl-3-methoxy-N-[1-(1-phenylethyl)pyrrolidin-3-yl]-1,2-oxazole-5-carboxamide has a molecular weight of 343.43 g/mol, XLogP of 2.98, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-methoxy-N-[1-(1-phenylethyl)pyrrolidin-3-yl]-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 75507595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).