(4S)-4-quinolin-2-ylimidazolidin-2-one

C12H11N3O — CID 171252662

IUPAC(4S)-4-quinolin-2-ylimidazolidin-2-one
SMILESO=C1NC[C@@H](c2ccc3ccccc3n2)N1
InChIInChI=1S/C12H11N3O/c16-12-13-7-11(15-12)10-6-5-8-3-1-2-4-9(8)14-10/h1-6,11H,7H2,(H2,13,15,16)/t11-/m0/s1
InChIKeyDWKUGMOPGIZMLH-NSHDSACASA-N
MW213.24 g/mol
LogP1.59
Rot. Bonds1

About (4S)-4-quinolin-2-ylimidazolidin-2-one

(4S)-4-quinolin-2-ylimidazolidin-2-one (PubChem CID 171252662) has the molecular formula C12H11N3O and a molecular weight of 213.24 g/mol. Its IUPAC name is (4S)-4-quinolin-2-ylimidazolidin-2-one.

Molecular Properties

Compound Name(4S)-4-quinolin-2-ylimidazolidin-2-one
PubChem CID171252662
Molecular FormulaC12H11N3O
Molecular Weight213.24 g/mol
Exact Mass213.09
IUPAC Name(4S)-4-quinolin-2-ylimidazolidin-2-one
SMILESO=C1NC[C@@H](c2ccc3ccccc3n2)N1
InChIInChI=1S/C12H11N3O/c16-12-13-7-11(15-12)10-6-5-8-3-1-2-4-9(8)14-10/h1-6,11H,7H2,(H2,13,15,16)/t11-/m0/s1
InChIKeyDWKUGMOPGIZMLH-NSHDSACASA-N
XLogP1.59
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4S)-4-quinolin-2-ylimidazolidin-2-one?
The IUPAC name of (4S)-4-quinolin-2-ylimidazolidin-2-one (CID 171252662) is (4S)-4-quinolin-2-ylimidazolidin-2-one.
What is the SMILES notation for (4S)-4-quinolin-2-ylimidazolidin-2-one?
The canonical SMILES for (4S)-4-quinolin-2-ylimidazolidin-2-one is O=C1NC[C@@H](c2ccc3ccccc3n2)N1.
What is the InChIKey of (4S)-4-quinolin-2-ylimidazolidin-2-one?
The InChIKey is DWKUGMOPGIZMLH-NSHDSACASA-N. The full InChI is InChI=1S/C12H11N3O/c16-12-13-7-11(15-12)10-6-5-8-3-1-2-4-9(8)14-10/h1-6,11H,7H2,(H2,13,15,16)/t11-/m0/s1.
What are the key properties of (4S)-4-quinolin-2-ylimidazolidin-2-one?
(4S)-4-quinolin-2-ylimidazolidin-2-one has a molecular weight of 213.24 g/mol, XLogP of 1.59, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-quinolin-2-ylimidazolidin-2-one is sourced from PubChem (CID 171252662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).