1-cyclopropyl-3-(2-hydroxyethyl)imidazol-2-one

C8H12N2O2 — CID 80582110

IUPAC1-cyclopropyl-3-(2-hydroxyethyl)imidazol-2-one
SMILESO=c1n(CCO)ccn1C1CC1
InChIInChI=1S/C8H12N2O2/c11-6-5-9-3-4-10(8(9)12)7-1-2-7/h3-4,7,11H,1-2,5-6H2
InChIKeySNBSNRHHDVSPCO-UHFFFAOYSA-N
MW168.20 g/mol
LogP-0.02
Rot. Bonds3

About 1-cyclopropyl-3-(2-hydroxyethyl)imidazol-2-one

1-cyclopropyl-3-(2-hydroxyethyl)imidazol-2-one (PubChem CID 80582110) has the molecular formula C8H12N2O2 and a molecular weight of 168.20 g/mol. Its IUPAC name is 1-cyclopropyl-3-(2-hydroxyethyl)imidazol-2-one.

Molecular Properties

Compound Name1-cyclopropyl-3-(2-hydroxyethyl)imidazol-2-one
PubChem CID80582110
Molecular FormulaC8H12N2O2
Molecular Weight168.20 g/mol
Exact Mass168.09
IUPAC Name1-cyclopropyl-3-(2-hydroxyethyl)imidazol-2-one
SMILESO=c1n(CCO)ccn1C1CC1
InChIInChI=1S/C8H12N2O2/c11-6-5-9-3-4-10(8(9)12)7-1-2-7/h3-4,7,11H,1-2,5-6H2
InChIKeySNBSNRHHDVSPCO-UHFFFAOYSA-N
XLogP-0.02
TPSA47.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(2-hydroxyethyl)imidazol-2-one?
The IUPAC name of 1-cyclopropyl-3-(2-hydroxyethyl)imidazol-2-one (CID 80582110) is 1-cyclopropyl-3-(2-hydroxyethyl)imidazol-2-one.
What is the SMILES notation for 1-cyclopropyl-3-(2-hydroxyethyl)imidazol-2-one?
The canonical SMILES for 1-cyclopropyl-3-(2-hydroxyethyl)imidazol-2-one is O=c1n(CCO)ccn1C1CC1.
What is the InChIKey of 1-cyclopropyl-3-(2-hydroxyethyl)imidazol-2-one?
The InChIKey is SNBSNRHHDVSPCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O2/c11-6-5-9-3-4-10(8(9)12)7-1-2-7/h3-4,7,11H,1-2,5-6H2.
What are the key properties of 1-cyclopropyl-3-(2-hydroxyethyl)imidazol-2-one?
1-cyclopropyl-3-(2-hydroxyethyl)imidazol-2-one has a molecular weight of 168.20 g/mol, XLogP of -0.02, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(2-hydroxyethyl)imidazol-2-one is sourced from PubChem (CID 80582110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).