3-[2-(2-cyclopropylimidazol-1-yl)ethyl]-1,3-oxazolidin-2-one

C11H15N3O2 — CID 56862537

IUPAC3-[2-(2-cyclopropylimidazol-1-yl)ethyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1CCn1ccnc1C1CC1
InChIInChI=1S/C11H15N3O2/c15-11-14(7-8-16-11)6-5-13-4-3-12-10(13)9-1-2-9/h3-4,9H,1-2,5-8H2
InChIKeyZRSAKIWARMIGOX-UHFFFAOYSA-N
MW221.26 g/mol
LogP1.21
Rot. Bonds4

About 3-[2-(2-cyclopropylimidazol-1-yl)ethyl]-1,3-oxazolidin-2-one

3-[2-(2-cyclopropylimidazol-1-yl)ethyl]-1,3-oxazolidin-2-one (PubChem CID 56862537) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is 3-[2-(2-cyclopropylimidazol-1-yl)ethyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[2-(2-cyclopropylimidazol-1-yl)ethyl]-1,3-oxazolidin-2-one
PubChem CID56862537
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC Name3-[2-(2-cyclopropylimidazol-1-yl)ethyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1CCn1ccnc1C1CC1
InChIInChI=1S/C11H15N3O2/c15-11-14(7-8-16-11)6-5-13-4-3-12-10(13)9-1-2-9/h3-4,9H,1-2,5-8H2
InChIKeyZRSAKIWARMIGOX-UHFFFAOYSA-N
XLogP1.21
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 51.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-cyclopropylimidazol-1-yl)ethyl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[2-(2-cyclopropylimidazol-1-yl)ethyl]-1,3-oxazolidin-2-one (CID 56862537) is 3-[2-(2-cyclopropylimidazol-1-yl)ethyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[2-(2-cyclopropylimidazol-1-yl)ethyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[2-(2-cyclopropylimidazol-1-yl)ethyl]-1,3-oxazolidin-2-one is O=C1OCCN1CCn1ccnc1C1CC1.
What is the InChIKey of 3-[2-(2-cyclopropylimidazol-1-yl)ethyl]-1,3-oxazolidin-2-one?
The InChIKey is ZRSAKIWARMIGOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c15-11-14(7-8-16-11)6-5-13-4-3-12-10(13)9-1-2-9/h3-4,9H,1-2,5-8H2.
What are the key properties of 3-[2-(2-cyclopropylimidazol-1-yl)ethyl]-1,3-oxazolidin-2-one?
3-[2-(2-cyclopropylimidazol-1-yl)ethyl]-1,3-oxazolidin-2-one has a molecular weight of 221.26 g/mol, XLogP of 1.21, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-cyclopropylimidazol-1-yl)ethyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 56862537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).