1-[2,6-di(propan-2-yl)phenyl]-3-[3-methoxy-2,6-di(propan-2-yl)phenyl]imidazolidine

C28H42N2O — CID 141260478

IUPAC1-[2,6-di(propan-2-yl)phenyl]-3-[3-methoxy-2,6-di(propan-2-yl)phenyl]imidazolidine
SMILESCOc1ccc(C(C)C)c(N2CCN(c3c(C(C)C)cccc3C(C)C)C2)c1C(C)C
InChIInChI=1S/C28H42N2O/c1-18(2)22-11-10-12-23(19(3)4)27(22)29-15-16-30(17-29)28-24(20(5)6)13-14-25(31-9)26(28)21(7)8/h10-14,18-21H,15-17H2,1-9H3
InChIKeyCEUVPMRYSALUTK-UHFFFAOYSA-N
MW422.66 g/mol
LogP7.47
Rot. Bonds7

About 1-[2,6-di(propan-2-yl)phenyl]-3-[3-methoxy-2,6-di(propan-2-yl)phenyl]imidazolidine

1-[2,6-di(propan-2-yl)phenyl]-3-[3-methoxy-2,6-di(propan-2-yl)phenyl]imidazolidine (PubChem CID 141260478) has the molecular formula C28H42N2O and a molecular weight of 422.66 g/mol. Its IUPAC name is 1-[2,6-di(propan-2-yl)phenyl]-3-[3-methoxy-2,6-di(propan-2-yl)phenyl]imidazolidine.

Molecular Properties

Compound Name1-[2,6-di(propan-2-yl)phenyl]-3-[3-methoxy-2,6-di(propan-2-yl)phenyl]imidazolidine
PubChem CID141260478
Molecular FormulaC28H42N2O
Molecular Weight422.66 g/mol
Exact Mass422.33
IUPAC Name1-[2,6-di(propan-2-yl)phenyl]-3-[3-methoxy-2,6-di(propan-2-yl)phenyl]imidazolidine
SMILESCOc1ccc(C(C)C)c(N2CCN(c3c(C(C)C)cccc3C(C)C)C2)c1C(C)C
InChIInChI=1S/C28H42N2O/c1-18(2)22-11-10-12-23(19(3)4)27(22)29-15-16-30(17-29)28-24(20(5)6)13-14-25(31-9)26(28)21(7)8/h10-14,18-21H,15-17H2,1-9H3
InChIKeyCEUVPMRYSALUTK-UHFFFAOYSA-N
XLogP7.47
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500422.66
LogP ≤ 57.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-[2,6-di(propan-2-yl)phenyl]-3-[3-methoxy-2,6-di(propan-2-yl)phenyl]imidazolidine 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

1,4,7-tris[2,6-di(propan-2-yl)phenyl]-1,4,7-triazonane
CID 20681040
1-[2,6-di(propan-2-yl)phenyl]piperidine
CID 10634131
N-(2-methoxyphenyl)-4-(2-methyl-6-propan-2-ylphenyl)piperazine-1-carboxamide
CID 113112535
ethane;1-methoxy-2-propan-2-ylbenzene
CID 144548142
ethane;1-methoxy-2-propan-2-ylbenzene
CID 142030907
1,3-bis[2,6-di(propan-2-yl)phenyl]-4,4-dimethylimidazolidine
CID 71019583
1,3-bis[4-methoxy-2,6-bis[(1R)-1-phenylethyl]phenyl]imidazolidine
CID 161065401
1,3-bis[4-methoxy-2,6-bis(1-phenylethyl)phenyl]imidazolidine
CID 175206372
(2S)-2-[3-[2,6-di(propan-2-yl)phenyl]imidazolidin-1-yl]-3,3-dimethylbutan-1-ol
CID 134943461
1,3-bis[4-methoxy-2,6-bis[(1R)-1-phenylethyl]phenyl]imidazolidine;hydrochloride
CID 175206370
1-[2-methoxy-6-(4-methylpiperazin-1-yl)phenyl]ethanamine
CID 113388932
4-[2,6-di(propan-2-yl)phenyl]-N-(2-methoxyethyl)piperazine-1-carboxamide
CID 113105129

Frequently Asked Questions

What is the IUPAC name of 1-[2,6-di(propan-2-yl)phenyl]-3-[3-methoxy-2,6-di(propan-2-yl)phenyl]imidazolidine?
The IUPAC name of 1-[2,6-di(propan-2-yl)phenyl]-3-[3-methoxy-2,6-di(propan-2-yl)phenyl]imidazolidine (CID 141260478) is 1-[2,6-di(propan-2-yl)phenyl]-3-[3-methoxy-2,6-di(propan-2-yl)phenyl]imidazolidine.
What is the SMILES notation for 1-[2,6-di(propan-2-yl)phenyl]-3-[3-methoxy-2,6-di(propan-2-yl)phenyl]imidazolidine?
The canonical SMILES for 1-[2,6-di(propan-2-yl)phenyl]-3-[3-methoxy-2,6-di(propan-2-yl)phenyl]imidazolidine is COc1ccc(C(C)C)c(N2CCN(c3c(C(C)C)cccc3C(C)C)C2)c1C(C)C.
What is the InChIKey of 1-[2,6-di(propan-2-yl)phenyl]-3-[3-methoxy-2,6-di(propan-2-yl)phenyl]imidazolidine?
The InChIKey is CEUVPMRYSALUTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H42N2O/c1-18(2)22-11-10-12-23(19(3)4)27(22)29-15-16-30(17-29)28-24(20(5)6)13-14-25(31-9)26(28)21(7)8/h10-14,18-21H,15-17H2,1-9H3.
What are the key properties of 1-[2,6-di(propan-2-yl)phenyl]-3-[3-methoxy-2,6-di(propan-2-yl)phenyl]imidazolidine?
1-[2,6-di(propan-2-yl)phenyl]-3-[3-methoxy-2,6-di(propan-2-yl)phenyl]imidazolidine has a molecular weight of 422.66 g/mol, XLogP of 7.47, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2,6-di(propan-2-yl)phenyl]-3-[3-methoxy-2,6-di(propan-2-yl)phenyl]imidazolidine is sourced from PubChem (CID 141260478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).