oxolan-2-yl-(2-phenylpyrrolidin-1-yl)methanone

C15H19NO2 — CID 42940601

IUPACoxolan-2-yl-(2-phenylpyrrolidin-1-yl)methanone
SMILESO=C(C1CCCO1)N1CCCC1c1ccccc1
InChIInChI=1S/C15H19NO2/c17-15(14-9-5-11-18-14)16-10-4-8-13(16)12-6-2-1-3-7-12/h1-3,6-7,13-14H,4-5,8-11H2
InChIKeyAKWHVVRKTHCRKE-UHFFFAOYSA-N
MW245.32 g/mol
LogP2.53
Rot. Bonds2

About oxolan-2-yl-(2-phenylpyrrolidin-1-yl)methanone

oxolan-2-yl-(2-phenylpyrrolidin-1-yl)methanone (PubChem CID 42940601) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is oxolan-2-yl-(2-phenylpyrrolidin-1-yl)methanone.

Molecular Properties

Compound Nameoxolan-2-yl-(2-phenylpyrrolidin-1-yl)methanone
PubChem CID42940601
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Nameoxolan-2-yl-(2-phenylpyrrolidin-1-yl)methanone
SMILESO=C(C1CCCO1)N1CCCC1c1ccccc1
InChIInChI=1S/C15H19NO2/c17-15(14-9-5-11-18-14)16-10-4-8-13(16)12-6-2-1-3-7-12/h1-3,6-7,13-14H,4-5,8-11H2
InChIKeyAKWHVVRKTHCRKE-UHFFFAOYSA-N
XLogP2.53
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of oxolan-2-yl-(2-phenylpyrrolidin-1-yl)methanone?
The IUPAC name of oxolan-2-yl-(2-phenylpyrrolidin-1-yl)methanone (CID 42940601) is oxolan-2-yl-(2-phenylpyrrolidin-1-yl)methanone.
What is the SMILES notation for oxolan-2-yl-(2-phenylpyrrolidin-1-yl)methanone?
The canonical SMILES for oxolan-2-yl-(2-phenylpyrrolidin-1-yl)methanone is O=C(C1CCCO1)N1CCCC1c1ccccc1.
What is the InChIKey of oxolan-2-yl-(2-phenylpyrrolidin-1-yl)methanone?
The InChIKey is AKWHVVRKTHCRKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c17-15(14-9-5-11-18-14)16-10-4-8-13(16)12-6-2-1-3-7-12/h1-3,6-7,13-14H,4-5,8-11H2.
What are the key properties of oxolan-2-yl-(2-phenylpyrrolidin-1-yl)methanone?
oxolan-2-yl-(2-phenylpyrrolidin-1-yl)methanone has a molecular weight of 245.32 g/mol, XLogP of 2.53, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for oxolan-2-yl-(2-phenylpyrrolidin-1-yl)methanone is sourced from PubChem (CID 42940601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).