1-(3-chlorophenyl)-3-[2-(1,3-dihydroisoindol-2-yl)ethyl]imidazolidin-2-one

C19H20ClN3O — CID 44517726

IUPAC1-(3-chlorophenyl)-3-[2-(1,3-dihydroisoindol-2-yl)ethyl]imidazolidin-2-one
SMILESO=C1N(CCN2Cc3ccccc3C2)CCN1c1cccc(Cl)c1
InChIInChI=1S/C19H20ClN3O/c20-17-6-3-7-18(12-17)23-11-10-22(19(23)24)9-8-21-13-15-4-1-2-5-16(15)14-21/h1-7,12H,8-11,13-14H2
InChIKeyTZQRQWWAQZCVET-UHFFFAOYSA-N
MW341.84 g/mol
LogP3.60
Rot. Bonds4

About 1-(3-chlorophenyl)-3-[2-(1,3-dihydroisoindol-2-yl)ethyl]imidazolidin-2-one

1-(3-chlorophenyl)-3-[2-(1,3-dihydroisoindol-2-yl)ethyl]imidazolidin-2-one (PubChem CID 44517726) has the molecular formula C19H20ClN3O and a molecular weight of 341.84 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-3-[2-(1,3-dihydroisoindol-2-yl)ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-(3-chlorophenyl)-3-[2-(1,3-dihydroisoindol-2-yl)ethyl]imidazolidin-2-one
PubChem CID44517726
Molecular FormulaC19H20ClN3O
Molecular Weight341.84 g/mol
Exact Mass341.13
IUPAC Name1-(3-chlorophenyl)-3-[2-(1,3-dihydroisoindol-2-yl)ethyl]imidazolidin-2-one
SMILESO=C1N(CCN2Cc3ccccc3C2)CCN1c1cccc(Cl)c1
InChIInChI=1S/C19H20ClN3O/c20-17-6-3-7-18(12-17)23-11-10-22(19(23)24)9-8-21-13-15-4-1-2-5-16(15)14-21/h1-7,12H,8-11,13-14H2
InChIKeyTZQRQWWAQZCVET-UHFFFAOYSA-N
XLogP3.60
TPSA26.79 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.84
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-3-[(4-isopropylphenyl)methyl]-1H-benzimidazol-2-one
CID 5276381
1-(4-Chloro-benzyl)-3-methyl-1,3-dihydro-benzoimidazol-2-one
CID 761915
1-(2-chlorobenzyl)-3-methyl-1,3-dihydro-2H-benzimidazol-2-one
CID 761927
1-(4-chlorobenzyl)-1,3-dihydro-2H-benzimidazol-2-one
CID 4681038
1-(4-chlorobenzyl)-3-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]imidazolidin-2-one
CID 3243556
2-(3-Chloro-phenyl)-3-phenyl-tetrahydro-pyrazolo[1,2-a][1,2,4]triazol-1-one
CID 3514222
[4-(4-Chloro-benzyl)-piperazin-1-yl]-(2,3-dihydro-indol-1-yl)-methanone
CID 44336059
1-(3-Chloro-4-fluorophenyl)-3-[2-(1,3-dihydroisoindol-2-yl)ethyl]imidazolidin-2-one
CID 45267251
3-[3-[2-(1,3-Dihydroisoindol-2-yl)ethyl]-2-oxoimidazolidin-1-yl]benzonitrile
CID 45267254
1-[(4-Chlorophenyl)methyl]-3-[2-(1,3-dihydroisoindol-2-yl)ethyl]imidazolidin-2-one
CID 45267262
1-[2-[(1R,4S)-2-azabicyclo[2.2.1]heptan-2-yl]ethyl]-3-(3-chlorophenyl)imidazolidin-2-one
CID 45267471
1-[2-[(1R,10S)-11-azatricyclo[8.2.2.03,8]tetradeca-3,5,7-trien-11-yl]ethyl]-3-(3-chlorophenyl)imidazolidin-2-one
CID 45267480

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-3-[2-(1,3-dihydroisoindol-2-yl)ethyl]imidazolidin-2-one?
The IUPAC name of 1-(3-chlorophenyl)-3-[2-(1,3-dihydroisoindol-2-yl)ethyl]imidazolidin-2-one (CID 44517726) is 1-(3-chlorophenyl)-3-[2-(1,3-dihydroisoindol-2-yl)ethyl]imidazolidin-2-one.
What is the SMILES notation for 1-(3-chlorophenyl)-3-[2-(1,3-dihydroisoindol-2-yl)ethyl]imidazolidin-2-one?
The canonical SMILES for 1-(3-chlorophenyl)-3-[2-(1,3-dihydroisoindol-2-yl)ethyl]imidazolidin-2-one is O=C1N(CCN2Cc3ccccc3C2)CCN1c1cccc(Cl)c1.
What is the InChIKey of 1-(3-chlorophenyl)-3-[2-(1,3-dihydroisoindol-2-yl)ethyl]imidazolidin-2-one?
The InChIKey is TZQRQWWAQZCVET-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClN3O/c20-17-6-3-7-18(12-17)23-11-10-22(19(23)24)9-8-21-13-15-4-1-2-5-16(15)14-21/h1-7,12H,8-11,13-14H2.
What are the key properties of 1-(3-chlorophenyl)-3-[2-(1,3-dihydroisoindol-2-yl)ethyl]imidazolidin-2-one?
1-(3-chlorophenyl)-3-[2-(1,3-dihydroisoindol-2-yl)ethyl]imidazolidin-2-one has a molecular weight of 341.84 g/mol, XLogP of 3.60, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-3-[2-(1,3-dihydroisoindol-2-yl)ethyl]imidazolidin-2-one is sourced from PubChem (CID 44517726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).