5-oxo-N-(1-phenylcyclobutyl)pyrrolidine-2-carboxamide

C15H18N2O2 — CID 110482244

IUPAC5-oxo-N-(1-phenylcyclobutyl)pyrrolidine-2-carboxamide
SMILESO=C1CCC(C(=O)NC2(c3ccccc3)CCC2)N1
InChIInChI=1S/C15H18N2O2/c18-13-8-7-12(16-13)14(19)17-15(9-4-10-15)11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2,(H,16,18)(H,17,19)
InChIKeyLDVBRXVOTTVIOP-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.46
Rot. Bonds3

About 5-oxo-N-(1-phenylcyclobutyl)pyrrolidine-2-carboxamide

5-oxo-N-(1-phenylcyclobutyl)pyrrolidine-2-carboxamide (PubChem CID 110482244) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 5-oxo-N-(1-phenylcyclobutyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name5-oxo-N-(1-phenylcyclobutyl)pyrrolidine-2-carboxamide
PubChem CID110482244
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name5-oxo-N-(1-phenylcyclobutyl)pyrrolidine-2-carboxamide
SMILESO=C1CCC(C(=O)NC2(c3ccccc3)CCC2)N1
InChIInChI=1S/C15H18N2O2/c18-13-8-7-12(16-13)14(19)17-15(9-4-10-15)11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2,(H,16,18)(H,17,19)
InChIKeyLDVBRXVOTTVIOP-UHFFFAOYSA-N
XLogP1.46
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-oxo-N-(1-phenylcyclobutyl)pyrrolidine-2-carboxamide?
The IUPAC name of 5-oxo-N-(1-phenylcyclobutyl)pyrrolidine-2-carboxamide (CID 110482244) is 5-oxo-N-(1-phenylcyclobutyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 5-oxo-N-(1-phenylcyclobutyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 5-oxo-N-(1-phenylcyclobutyl)pyrrolidine-2-carboxamide is O=C1CCC(C(=O)NC2(c3ccccc3)CCC2)N1.
What is the InChIKey of 5-oxo-N-(1-phenylcyclobutyl)pyrrolidine-2-carboxamide?
The InChIKey is LDVBRXVOTTVIOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c18-13-8-7-12(16-13)14(19)17-15(9-4-10-15)11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2,(H,16,18)(H,17,19).
What are the key properties of 5-oxo-N-(1-phenylcyclobutyl)pyrrolidine-2-carboxamide?
5-oxo-N-(1-phenylcyclobutyl)pyrrolidine-2-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 1.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-N-(1-phenylcyclobutyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 110482244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).