1-(5-hydroxy-2-adamantyl)-3-[(1S)-1-(3-methoxyphenyl)ethyl]imidazolidin-2-one

C22H30N2O3 — CID 24952608

IUPAC1-(5-hydroxy-2-adamantyl)-3-[(1S)-1-(3-methoxyphenyl)ethyl]imidazolidin-2-one
SMILESCOc1cccc([C@H](C)N2CCN(C3C4CC5CC3CC(O)(C5)C4)C2=O)c1
InChIInChI=1S/C22H30N2O3/c1-14(16-4-3-5-19(10-16)27-2)23-6-7-24(21(23)25)20-17-8-15-9-18(20)13-22(26,11-15)12-17/h3-5,10,14-15,17-18,20,26H,6-9,11-13H2,1-2H3/t14-,15?,17?,18?,20?,22?/m0/s1
InChIKeyRJIBZTRLLVFALE-QIDZMIKESA-N
MW370.49 g/mol
LogP3.43
Rot. Bonds4

About 1-(5-hydroxy-2-adamantyl)-3-[(1S)-1-(3-methoxyphenyl)ethyl]imidazolidin-2-one

1-(5-hydroxy-2-adamantyl)-3-[(1S)-1-(3-methoxyphenyl)ethyl]imidazolidin-2-one (PubChem CID 24952608) has the molecular formula C22H30N2O3 and a molecular weight of 370.49 g/mol. Its IUPAC name is 1-(5-hydroxy-2-adamantyl)-3-[(1S)-1-(3-methoxyphenyl)ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-(5-hydroxy-2-adamantyl)-3-[(1S)-1-(3-methoxyphenyl)ethyl]imidazolidin-2-one
PubChem CID24952608
Molecular FormulaC22H30N2O3
Molecular Weight370.49 g/mol
Exact Mass370.23
IUPAC Name1-(5-hydroxy-2-adamantyl)-3-[(1S)-1-(3-methoxyphenyl)ethyl]imidazolidin-2-one
SMILESCOc1cccc([C@H](C)N2CCN(C3C4CC5CC3CC(O)(C5)C4)C2=O)c1
InChIInChI=1S/C22H30N2O3/c1-14(16-4-3-5-19(10-16)27-2)23-6-7-24(21(23)25)20-17-8-15-9-18(20)13-22(26,11-15)12-17/h3-5,10,14-15,17-18,20,26H,6-9,11-13H2,1-2H3/t14-,15?,17?,18?,20?,22?/m0/s1
InChIKeyRJIBZTRLLVFALE-QIDZMIKESA-N
XLogP3.43
TPSA53.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.49
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(5-hydroxy-2-adamantyl)-3-[(1S)-1-(3-methoxyphenyl)ethyl]imidazolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9-hydroxy-3-[(1S)-1-(3-methoxyphenyl)ethyl]-1-oxa-3-azaspiro[5.5]undecan-2-one
CID 160709287
1-(5-hydroxy-2-adamantyl)-4-(2-methoxyphenyl)-4-methylimidazolidin-2-one
CID 57495574
1'-(5-hydroxy-2-adamantyl)-3'-methylspiro[1,3-dihydroindene-2,4'-imidazolidine]-2'-one
CID 57495538
1-(benzenesulfonyl)-4-[(1S)-1-(3-methoxyphenyl)ethyl]piperazine
CID 95760565
3-ethyl-N-(5-hydroxy-2-adamantyl)-5-(3-methoxybenzoyl)-1-methylpyrrole-2-carboxamide
CID 56941033
1-(2,3,3a,4,5,9b-hexahydro-1H-benzo[e]indazol-7-yl)-3-[(1R)-1-(3-methoxyphenyl)ethyl]imidazolidin-2-one
CID 155490044
[4-[(1S)-1-(3-methoxyphenyl)ethyl]piperazin-1-yl]-(3-methyl-1,2-thiazol-4-yl)methanone
CID 99820617
2-cyclopropyl-2-(3-methoxyphenyl)acetic acid
CID 82024075
(3R)-N-(3-methoxyphenyl)-5-oxo-1-[(1S)-1-phenylethyl]pyrrolidine-3-carboxamide
CID 1260369
4-[2-[1-[1-(3-methoxyphenyl)ethyl]-2,3-dihydroindol-7-yl]ethyl]benzoic acid
CID 174982076
3-[(1S)-1-(3-hydroxyphenyl)ethyl]-6-methyl-6-phenyl-1,3-oxazinan-2-one;3-[(1S)-1-(3-methoxyphenyl)ethyl]-6-methyl-6-phenyl-1,3-oxazinan-2-one;sulfane
CID 159792259
2-(1-adamantyl)-1-(3-methoxyphenyl)ethanamine
CID 115785843

Frequently Asked Questions

What is the IUPAC name of 1-(5-hydroxy-2-adamantyl)-3-[(1S)-1-(3-methoxyphenyl)ethyl]imidazolidin-2-one?
The IUPAC name of 1-(5-hydroxy-2-adamantyl)-3-[(1S)-1-(3-methoxyphenyl)ethyl]imidazolidin-2-one (CID 24952608) is 1-(5-hydroxy-2-adamantyl)-3-[(1S)-1-(3-methoxyphenyl)ethyl]imidazolidin-2-one.
What is the SMILES notation for 1-(5-hydroxy-2-adamantyl)-3-[(1S)-1-(3-methoxyphenyl)ethyl]imidazolidin-2-one?
The canonical SMILES for 1-(5-hydroxy-2-adamantyl)-3-[(1S)-1-(3-methoxyphenyl)ethyl]imidazolidin-2-one is COc1cccc([C@H](C)N2CCN(C3C4CC5CC3CC(O)(C5)C4)C2=O)c1.
What is the InChIKey of 1-(5-hydroxy-2-adamantyl)-3-[(1S)-1-(3-methoxyphenyl)ethyl]imidazolidin-2-one?
The InChIKey is RJIBZTRLLVFALE-QIDZMIKESA-N. The full InChI is InChI=1S/C22H30N2O3/c1-14(16-4-3-5-19(10-16)27-2)23-6-7-24(21(23)25)20-17-8-15-9-18(20)13-22(26,11-15)12-17/h3-5,10,14-15,17-18,20,26H,6-9,11-13H2,1-2H3/t14-,15?,17?,18?,20?,22?/m0/s1.
What are the key properties of 1-(5-hydroxy-2-adamantyl)-3-[(1S)-1-(3-methoxyphenyl)ethyl]imidazolidin-2-one?
1-(5-hydroxy-2-adamantyl)-3-[(1S)-1-(3-methoxyphenyl)ethyl]imidazolidin-2-one has a molecular weight of 370.49 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-hydroxy-2-adamantyl)-3-[(1S)-1-(3-methoxyphenyl)ethyl]imidazolidin-2-one is sourced from PubChem (CID 24952608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).