(4R)-1-nitroso-4-phenylimidazolidin-2-one

C9H9N3O2 — CID 142070410

IUPAC(4R)-1-nitroso-4-phenylimidazolidin-2-one
SMILESO=NN1C[C@@H](c2ccccc2)NC1=O
InChIInChI=1S/C9H9N3O2/c13-9-10-8(6-12(9)11-14)7-4-2-1-3-5-7/h1-5,8H,6H2,(H,10,13)/t8-/m0/s1
InChIKeyLANYGNFJCQGDPM-QMMMGPOBSA-N
MW191.19 g/mol
LogP1.43
Rot. Bonds2

About (4R)-1-nitroso-4-phenylimidazolidin-2-one

(4R)-1-nitroso-4-phenylimidazolidin-2-one (PubChem CID 142070410) has the molecular formula C9H9N3O2 and a molecular weight of 191.19 g/mol. Its IUPAC name is (4R)-1-nitroso-4-phenylimidazolidin-2-one.

Molecular Properties

Compound Name(4R)-1-nitroso-4-phenylimidazolidin-2-one
PubChem CID142070410
Molecular FormulaC9H9N3O2
Molecular Weight191.19 g/mol
Exact Mass191.07
IUPAC Name(4R)-1-nitroso-4-phenylimidazolidin-2-one
SMILESO=NN1C[C@@H](c2ccccc2)NC1=O
InChIInChI=1S/C9H9N3O2/c13-9-10-8(6-12(9)11-14)7-4-2-1-3-5-7/h1-5,8H,6H2,(H,10,13)/t8-/m0/s1
InChIKeyLANYGNFJCQGDPM-QMMMGPOBSA-N
XLogP1.43
TPSA61.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-nitroso', 'substructure': 'N/A'}

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Related Compounds

(4S)-1,4-diphenylimidazolidin-2-one
CID 163207794
(4S)-1-benzyl-4-phenylimidazolidin-2-one
CID 142669129
1-(1-hydroxyethyl)-4-phenylimidazolidin-2-one
CID 70630511
2-oxo-6-phenylpiperidine-3-carboxylic acid
CID 71651347
(4S)-1-[(4-aminophenyl)methyl]-4-phenylimidazolidin-2-one
CID 142669131
(4R)-1-(4-methylsulfonylphenyl)-4-phenylimidazolidin-2-one
CID 163902103
(4R)-N,1-dimethyl-4-phenylimidazolidin-2-imine
CID 142070445
tert-butyl (4S)-2-oxo-4-phenylimidazolidine-1-carboxylate
CID 155394671
methyl 2-methyl-2-(2-oxo-4-phenylimidazolidin-1-yl)propanoate
CID 116980390
1-methyl-4-(4-phenoxyphenyl)imidazolidin-2-one
CID 116980839
(2S,5R)-5-phenylpyrrolidine-2-carboxylic acid;hydrochloride
CID 70544231
6-phenyl-3-propan-2-yl-1,3-diazinane-2,4-dione
CID 59370437

Frequently Asked Questions

What is the IUPAC name of (4R)-1-nitroso-4-phenylimidazolidin-2-one?
The IUPAC name of (4R)-1-nitroso-4-phenylimidazolidin-2-one (CID 142070410) is (4R)-1-nitroso-4-phenylimidazolidin-2-one.
What is the SMILES notation for (4R)-1-nitroso-4-phenylimidazolidin-2-one?
The canonical SMILES for (4R)-1-nitroso-4-phenylimidazolidin-2-one is O=NN1C[C@@H](c2ccccc2)NC1=O.
What is the InChIKey of (4R)-1-nitroso-4-phenylimidazolidin-2-one?
The InChIKey is LANYGNFJCQGDPM-QMMMGPOBSA-N. The full InChI is InChI=1S/C9H9N3O2/c13-9-10-8(6-12(9)11-14)7-4-2-1-3-5-7/h1-5,8H,6H2,(H,10,13)/t8-/m0/s1.
What are the key properties of (4R)-1-nitroso-4-phenylimidazolidin-2-one?
(4R)-1-nitroso-4-phenylimidazolidin-2-one has a molecular weight of 191.19 g/mol, XLogP of 1.43, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-1-nitroso-4-phenylimidazolidin-2-one is sourced from PubChem (CID 142070410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).