1-benzyl-2,4,5-triphenylimidazolidine

C28H26N2 — CID 12733567

IUPAC1-benzyl-2,4,5-triphenylimidazolidine
SMILESc1ccc(CN2C(c3ccccc3)NC(c3ccccc3)C2c2ccccc2)cc1
InChIInChI=1S/C28H26N2/c1-5-13-22(14-6-1)21-30-27(24-17-9-3-10-18-24)26(23-15-7-2-8-16-23)29-28(30)25-19-11-4-12-20-25/h1-20,26-29H,21H2
InChIKeyQNDKTWPPGXZQJI-UHFFFAOYSA-N
MW390.53 g/mol
LogP6.27
Rot. Bonds5

About 1-benzyl-2,4,5-triphenylimidazolidine

1-benzyl-2,4,5-triphenylimidazolidine (PubChem CID 12733567) has the molecular formula C28H26N2 and a molecular weight of 390.53 g/mol. Its IUPAC name is 1-benzyl-2,4,5-triphenylimidazolidine.

Molecular Properties

Compound Name1-benzyl-2,4,5-triphenylimidazolidine
PubChem CID12733567
Molecular FormulaC28H26N2
Molecular Weight390.53 g/mol
Exact Mass390.21
IUPAC Name1-benzyl-2,4,5-triphenylimidazolidine
SMILESc1ccc(CN2C(c3ccccc3)NC(c3ccccc3)C2c2ccccc2)cc1
InChIInChI=1S/C28H26N2/c1-5-13-22(14-6-1)21-30-27(24-17-9-3-10-18-24)26(23-15-7-2-8-16-23)29-28(30)25-19-11-4-12-20-25/h1-20,26-29H,21H2
InChIKeyQNDKTWPPGXZQJI-UHFFFAOYSA-N
XLogP6.27
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.53
LogP ≤ 56.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R,4R,5R)-1-benzyl-2-[3-[(2R,4R,5R)-1-benzyl-4,5-diphenylimidazolidin-2-yl]-5-tert-butylphenyl]-4,5-diphenylimidazolidine
CID 177421796
(2S,4R,5R)-1-benzyl-2-[3-[(2S,4R,5R)-1-benzyl-4,5-diphenylimidazolidin-2-yl]-2-iodophenyl]-4,5-diphenylimidazolidine
CID 132506504
(4R,5R)-1-benzyl-2-[3-[(4R,5R)-1-benzyl-4,5-diphenylimidazolidin-2-yl]-5-tert-butylbenzene-2-id-1-yl]-4,5-diphenylimidazolidine;chloropalladium(1+)
CID 71551254
(4R)-1,3-dibenzyl-4,5-diphenyl-1,3,2-diazaphospholidin-2-ium 2-oxide
CID 138962724
methyl (2S,4R,5R)-1-[(3-fluorophenyl)methyl]-2,5-diphenylimidazolidine-4-carboxylate
CID 138980057
(5S)-1,5-dibenzyl-2-phenylimidazolidin-4-one
CID 12013114
2-benzyl-4-phenyltriazetidine
CID 121323485
1-[(2S,3S)-1-benzyl-3-phenylaziridin-2-yl]ethanone
CID 23243955
(2S,6S)-1-benzyl-2,6-dimethyl-4-phenylpiperidine
CID 10039279
(4S,5S)-1,3-dibenzyl-4,5-diphenylimidazolidine-2-thione
CID 24767043
methyl (2R,3S)-1-benzyl-3-phenylaziridine-2-carboxylate
CID 23243948
3,5-diphenyl-1,2-diazabicyclo[2.1.0]pentane
CID 118675183

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-2,4,5-triphenylimidazolidine?
The IUPAC name of 1-benzyl-2,4,5-triphenylimidazolidine (CID 12733567) is 1-benzyl-2,4,5-triphenylimidazolidine.
What is the SMILES notation for 1-benzyl-2,4,5-triphenylimidazolidine?
The canonical SMILES for 1-benzyl-2,4,5-triphenylimidazolidine is c1ccc(CN2C(c3ccccc3)NC(c3ccccc3)C2c2ccccc2)cc1.
What is the InChIKey of 1-benzyl-2,4,5-triphenylimidazolidine?
The InChIKey is QNDKTWPPGXZQJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H26N2/c1-5-13-22(14-6-1)21-30-27(24-17-9-3-10-18-24)26(23-15-7-2-8-16-23)29-28(30)25-19-11-4-12-20-25/h1-20,26-29H,21H2.
What are the key properties of 1-benzyl-2,4,5-triphenylimidazolidine?
1-benzyl-2,4,5-triphenylimidazolidine has a molecular weight of 390.53 g/mol, XLogP of 6.27, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-2,4,5-triphenylimidazolidine is sourced from PubChem (CID 12733567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).