(2S)-2-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]imidazolidine

C24H24F2N2O — CID 92569268

IUPAC(2S)-2-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]imidazolidine
SMILESCOc1cccc(CN2CCN(Cc3ccc(F)cc3)[C@@H]2c2ccc(F)cc2)c1
InChIInChI=1S/C24H24F2N2O/c1-29-23-4-2-3-19(15-23)17-28-14-13-27(16-18-5-9-21(25)10-6-18)24(28)20-7-11-22(26)12-8-20/h2-12,15,24H,13-14,16-17H2,1H3/t24-/m0/s1
InChIKeyCOLOYVDRJAYGRI-DEOSSOPVSA-N
MW394.47 g/mol
LogP4.99
Rot. Bonds6

About (2S)-2-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]imidazolidine

(2S)-2-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]imidazolidine (PubChem CID 92569268) has the molecular formula C24H24F2N2O and a molecular weight of 394.47 g/mol. Its IUPAC name is (2S)-2-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]imidazolidine.

Molecular Properties

Compound Name(2S)-2-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]imidazolidine
PubChem CID92569268
Molecular FormulaC24H24F2N2O
Molecular Weight394.47 g/mol
Exact Mass394.19
IUPAC Name(2S)-2-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]imidazolidine
SMILESCOc1cccc(CN2CCN(Cc3ccc(F)cc3)[C@@H]2c2ccc(F)cc2)c1
InChIInChI=1S/C24H24F2N2O/c1-29-23-4-2-3-19(15-23)17-28-14-13-27(16-18-5-9-21(25)10-6-18)24(28)20-7-11-22(26)12-8-20/h2-12,15,24H,13-14,16-17H2,1H3/t24-/m0/s1
InChIKeyCOLOYVDRJAYGRI-DEOSSOPVSA-N
XLogP4.99
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.47
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-(4-ethoxyphenyl)-1-[(4-fluorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]imidazolidine
CID 92569271
1-[(4-fluorophenyl)methyl]-2-(3-methoxyphenyl)-3-[(4-methylphenyl)methyl]-1,3-diazinane
CID 15994936
(2R)-1-[(4-ethoxyphenyl)methyl]-2-(4-fluorophenyl)-3-[(3-methylphenyl)methyl]imidazolidine
CID 92569263
1-[(3-methoxyphenyl)methyl]-4-[(4-methoxyphenyl)methyl]piperazine
CID 2873492
1-[(4-ethoxyphenyl)methyl]-3-[(4-fluorophenyl)methyl]-2-(4-methylsulfanylphenyl)imidazolidine
CID 23653722
(2S)-2-(2-chlorophenyl)-1-[(4-chlorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]-1,3-diazinane
CID 92569496
2-(2-chlorophenyl)-1-[(4-chlorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]-1,3-diazinane
CID 20857150
1-benzyl-2-(4-methoxyphenyl)-3-[(4-nitrophenyl)methyl]imidazolidine
CID 101217629
2-[(4-fluorophenyl)methyl]-7-[(3-methoxyphenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one
CID 45223915
2-(chloromethyl)-1-[(3-methoxyphenyl)methyl]piperidine
CID 63386922
1-[(3-fluorophenyl)methyl]-2-(4-methoxyphenyl)pyrrolidine
CID 20895836
4-chloro-1-[(3-methoxyphenyl)methyl]piperidine
CID 63389704

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]imidazolidine?
The IUPAC name of (2S)-2-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]imidazolidine (CID 92569268) is (2S)-2-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]imidazolidine.
What is the SMILES notation for (2S)-2-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]imidazolidine?
The canonical SMILES for (2S)-2-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]imidazolidine is COc1cccc(CN2CCN(Cc3ccc(F)cc3)[C@@H]2c2ccc(F)cc2)c1.
What is the InChIKey of (2S)-2-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]imidazolidine?
The InChIKey is COLOYVDRJAYGRI-DEOSSOPVSA-N. The full InChI is InChI=1S/C24H24F2N2O/c1-29-23-4-2-3-19(15-23)17-28-14-13-27(16-18-5-9-21(25)10-6-18)24(28)20-7-11-22(26)12-8-20/h2-12,15,24H,13-14,16-17H2,1H3/t24-/m0/s1.
What are the key properties of (2S)-2-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]imidazolidine?
(2S)-2-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]imidazolidine has a molecular weight of 394.47 g/mol, XLogP of 4.99, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(4-fluorophenyl)-1-[(4-fluorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]imidazolidine is sourced from PubChem (CID 92569268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).