4-amino-5-(3-chlorophenyl)-1,5-dihydroimidazol-2-one

C9H8ClN3O — CID 79960805

IUPAC4-amino-5-(3-chlorophenyl)-1,5-dihydroimidazol-2-one
SMILESNC1=NC(=O)NC1c1cccc(Cl)c1
InChIInChI=1S/C9H8ClN3O/c10-6-3-1-2-5(4-6)7-8(11)13-9(14)12-7/h1-4,7H,(H3,11,12,13,14)
InChIKeyAENIUCZLYHRSNI-UHFFFAOYSA-N
MW209.64 g/mol
LogP1.46
Rot. Bonds1

About 4-amino-5-(3-chlorophenyl)-1,5-dihydroimidazol-2-one

4-amino-5-(3-chlorophenyl)-1,5-dihydroimidazol-2-one (PubChem CID 79960805) has the molecular formula C9H8ClN3O and a molecular weight of 209.64 g/mol. Its IUPAC name is 4-amino-5-(3-chlorophenyl)-1,5-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-amino-5-(3-chlorophenyl)-1,5-dihydroimidazol-2-one
PubChem CID79960805
Molecular FormulaC9H8ClN3O
Molecular Weight209.64 g/mol
Exact Mass209.04
IUPAC Name4-amino-5-(3-chlorophenyl)-1,5-dihydroimidazol-2-one
SMILESNC1=NC(=O)NC1c1cccc(Cl)c1
InChIInChI=1S/C9H8ClN3O/c10-6-3-1-2-5(4-6)7-8(11)13-9(14)12-7/h1-4,7H,(H3,11,12,13,14)
InChIKeyAENIUCZLYHRSNI-UHFFFAOYSA-N
XLogP1.46
TPSA67.48 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.64
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-5-(3-cyclopropylphenyl)-1,5-dihydroimidazol-2-one
CID 79962290
4-amino-5-(4-methylphenyl)-1,5-dihydroimidazol-2-one
CID 79961557
6-(3-chlorophenyl)piperidine-2,5-dione
CID 22106591
5-amino-4-(3-chlorophenyl)-3-(cyclopropylmethyl)-4H-imidazol-2-one
CID 79968106
2-(3-chlorophenyl)-1,3-thiazolidin-4-one
CID 5050533
(3R)-3-(3-chlorophenyl)-1,1-dioxo-2,3-dihydro-1,2,5-thiadiazol-5-ium-4-amine
CID 2042140
2-(3-chlorophenyl)pyrrolidin-3-one;hydrochloride
CID 115038654
4-(3-chlorophenyl)-1,3,4,7-tetrahydrofuro[3,4-d]pyrimidine-2,5-dione
CID 102567371
2,4-bis(3-chlorophenyl)-3-azabicyclo[3.3.1]nonan-9-one
CID 91327532
ethyl 6-(3-chlorophenyl)-4-methyl-2-oxo-5,6-dihydro-1H-pyrimidine-5-carboxylate
CID 91049028
1-chloro-3-cyclobutylbenzene;methane
CID 178166077
(4S,5S)-5-(3-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one
CID 134527726

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-(3-chlorophenyl)-1,5-dihydroimidazol-2-one?
The IUPAC name of 4-amino-5-(3-chlorophenyl)-1,5-dihydroimidazol-2-one (CID 79960805) is 4-amino-5-(3-chlorophenyl)-1,5-dihydroimidazol-2-one.
What is the SMILES notation for 4-amino-5-(3-chlorophenyl)-1,5-dihydroimidazol-2-one?
The canonical SMILES for 4-amino-5-(3-chlorophenyl)-1,5-dihydroimidazol-2-one is NC1=NC(=O)NC1c1cccc(Cl)c1.
What is the InChIKey of 4-amino-5-(3-chlorophenyl)-1,5-dihydroimidazol-2-one?
The InChIKey is AENIUCZLYHRSNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClN3O/c10-6-3-1-2-5(4-6)7-8(11)13-9(14)12-7/h1-4,7H,(H3,11,12,13,14).
What are the key properties of 4-amino-5-(3-chlorophenyl)-1,5-dihydroimidazol-2-one?
4-amino-5-(3-chlorophenyl)-1,5-dihydroimidazol-2-one has a molecular weight of 209.64 g/mol, XLogP of 1.46, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-(3-chlorophenyl)-1,5-dihydroimidazol-2-one is sourced from PubChem (CID 79960805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).