1-[2-[5-(2-ethylphenyl)-4-phenylimidazol-1-yl]ethyl]pyrrolidin-2-one

C23H25N3O — CID 50948298

IUPAC1-[2-[5-(2-ethylphenyl)-4-phenylimidazol-1-yl]ethyl]pyrrolidin-2-one
SMILESCCc1ccccc1-c1c(-c2ccccc2)ncn1CCN1CCCC1=O
InChIInChI=1S/C23H25N3O/c1-2-18-9-6-7-12-20(18)23-22(19-10-4-3-5-11-19)24-17-26(23)16-15-25-14-8-13-21(25)27/h3-7,9-12,17H,2,8,13-16H2,1H3
InChIKeySYFNAXFKGKLETI-UHFFFAOYSA-N
MW359.47 g/mol
LogP4.40
Rot. Bonds6

About 1-[2-[5-(2-ethylphenyl)-4-phenylimidazol-1-yl]ethyl]pyrrolidin-2-one

1-[2-[5-(2-ethylphenyl)-4-phenylimidazol-1-yl]ethyl]pyrrolidin-2-one (PubChem CID 50948298) has the molecular formula C23H25N3O and a molecular weight of 359.47 g/mol. Its IUPAC name is 1-[2-[5-(2-ethylphenyl)-4-phenylimidazol-1-yl]ethyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[2-[5-(2-ethylphenyl)-4-phenylimidazol-1-yl]ethyl]pyrrolidin-2-one
PubChem CID50948298
Molecular FormulaC23H25N3O
Molecular Weight359.47 g/mol
Exact Mass359.20
IUPAC Name1-[2-[5-(2-ethylphenyl)-4-phenylimidazol-1-yl]ethyl]pyrrolidin-2-one
SMILESCCc1ccccc1-c1c(-c2ccccc2)ncn1CCN1CCCC1=O
InChIInChI=1S/C23H25N3O/c1-2-18-9-6-7-12-20(18)23-22(19-10-4-3-5-11-19)24-17-26(23)16-15-25-14-8-13-21(25)27/h3-7,9-12,17H,2,8,13-16H2,1H3
InChIKeySYFNAXFKGKLETI-UHFFFAOYSA-N
XLogP4.40
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[5-(2-ethylphenyl)-4-phenylimidazol-1-yl]ethyl]pyrrolidin-2-one?
The IUPAC name of 1-[2-[5-(2-ethylphenyl)-4-phenylimidazol-1-yl]ethyl]pyrrolidin-2-one (CID 50948298) is 1-[2-[5-(2-ethylphenyl)-4-phenylimidazol-1-yl]ethyl]pyrrolidin-2-one.
What is the SMILES notation for 1-[2-[5-(2-ethylphenyl)-4-phenylimidazol-1-yl]ethyl]pyrrolidin-2-one?
The canonical SMILES for 1-[2-[5-(2-ethylphenyl)-4-phenylimidazol-1-yl]ethyl]pyrrolidin-2-one is CCc1ccccc1-c1c(-c2ccccc2)ncn1CCN1CCCC1=O.
What is the InChIKey of 1-[2-[5-(2-ethylphenyl)-4-phenylimidazol-1-yl]ethyl]pyrrolidin-2-one?
The InChIKey is SYFNAXFKGKLETI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O/c1-2-18-9-6-7-12-20(18)23-22(19-10-4-3-5-11-19)24-17-26(23)16-15-25-14-8-13-21(25)27/h3-7,9-12,17H,2,8,13-16H2,1H3.
What are the key properties of 1-[2-[5-(2-ethylphenyl)-4-phenylimidazol-1-yl]ethyl]pyrrolidin-2-one?
1-[2-[5-(2-ethylphenyl)-4-phenylimidazol-1-yl]ethyl]pyrrolidin-2-one has a molecular weight of 359.47 g/mol, XLogP of 4.40, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[5-(2-ethylphenyl)-4-phenylimidazol-1-yl]ethyl]pyrrolidin-2-one is sourced from PubChem (CID 50948298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).