N-(4-ethoxyphenyl)-2-(5-propyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide

C19H25N3O3 — CID 47001836

IUPACN-(4-ethoxyphenyl)-2-(5-propyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide
SMILESCCCc1cc(C2CCCN2C(=O)Nc2ccc(OCC)cc2)no1
InChIInChI=1S/C19H25N3O3/c1-3-6-16-13-17(21-25-16)18-7-5-12-22(18)19(23)20-14-8-10-15(11-9-14)24-4-2/h8-11,13,18H,3-7,12H2,1-2H3,(H,20,23)
InChIKeyFLOQBXJLTHEYNS-UHFFFAOYSA-N
MW343.43 g/mol
LogP4.39
Rot. Bonds6

About N-(4-ethoxyphenyl)-2-(5-propyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide

N-(4-ethoxyphenyl)-2-(5-propyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide (PubChem CID 47001836) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-2-(5-propyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-2-(5-propyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide
PubChem CID47001836
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC NameN-(4-ethoxyphenyl)-2-(5-propyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide
SMILESCCCc1cc(C2CCCN2C(=O)Nc2ccc(OCC)cc2)no1
InChIInChI=1S/C19H25N3O3/c1-3-6-16-13-17(21-25-16)18-7-5-12-22(18)19(23)20-14-8-10-15(11-9-14)24-4-2/h8-11,13,18H,3-7,12H2,1-2H3,(H,20,23)
InChIKeyFLOQBXJLTHEYNS-UHFFFAOYSA-N
XLogP4.39
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-2-(5-propyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide?
The IUPAC name of N-(4-ethoxyphenyl)-2-(5-propyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide (CID 47001836) is N-(4-ethoxyphenyl)-2-(5-propyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-(4-ethoxyphenyl)-2-(5-propyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-(4-ethoxyphenyl)-2-(5-propyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide is CCCc1cc(C2CCCN2C(=O)Nc2ccc(OCC)cc2)no1.
What is the InChIKey of N-(4-ethoxyphenyl)-2-(5-propyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide?
The InChIKey is FLOQBXJLTHEYNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-3-6-16-13-17(21-25-16)18-7-5-12-22(18)19(23)20-14-8-10-15(11-9-14)24-4-2/h8-11,13,18H,3-7,12H2,1-2H3,(H,20,23).
What are the key properties of N-(4-ethoxyphenyl)-2-(5-propyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide?
N-(4-ethoxyphenyl)-2-(5-propyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide has a molecular weight of 343.43 g/mol, XLogP of 4.39, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-2-(5-propyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 47001836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).