1-benzyl-3-[(4-chlorophenyl)methyl]-2-phenylimidazolidine

C23H23ClN2 — CID 101217631

IUPAC1-benzyl-3-[(4-chlorophenyl)methyl]-2-phenylimidazolidine
SMILESClc1ccc(CN2CCN(Cc3ccccc3)C2c2ccccc2)cc1
InChIInChI=1S/C23H23ClN2/c24-22-13-11-20(12-14-22)18-26-16-15-25(17-19-7-3-1-4-8-19)23(26)21-9-5-2-6-10-21/h1-14,23H,15-18H2
InChIKeyDVILMSVWCKEHFT-UHFFFAOYSA-N
MW362.90 g/mol
LogP5.36
Rot. Bonds5

About 1-benzyl-3-[(4-chlorophenyl)methyl]-2-phenylimidazolidine

1-benzyl-3-[(4-chlorophenyl)methyl]-2-phenylimidazolidine (PubChem CID 101217631) has the molecular formula C23H23ClN2 and a molecular weight of 362.90 g/mol. Its IUPAC name is 1-benzyl-3-[(4-chlorophenyl)methyl]-2-phenylimidazolidine.

Molecular Properties

Compound Name1-benzyl-3-[(4-chlorophenyl)methyl]-2-phenylimidazolidine
PubChem CID101217631
Molecular FormulaC23H23ClN2
Molecular Weight362.90 g/mol
Exact Mass362.15
IUPAC Name1-benzyl-3-[(4-chlorophenyl)methyl]-2-phenylimidazolidine
SMILESClc1ccc(CN2CCN(Cc3ccccc3)C2c2ccccc2)cc1
InChIInChI=1S/C23H23ClN2/c24-22-13-11-20(12-14-22)18-26-16-15-25(17-19-7-3-1-4-8-19)23(26)21-9-5-2-6-10-21/h1-14,23H,15-18H2
InChIKeyDVILMSVWCKEHFT-UHFFFAOYSA-N
XLogP5.36
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.90
LogP ≤ 55.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-dibenzyl-2-[2-[(4-chlorophenyl)methoxy]phenyl]imidazolidine
CID 3953341
1,3-dibenzyl-2-(4-nitrophenyl)imidazolidine
CID 1039680
4-benzyl-1-(4-chlorophenyl)-3-methylpiperazin-2-one
CID 24715820
4-benzyl-3-phenylpiperazin-1-amine
CID 3030044
1-benzyl-2-(4-chlorophenyl)piperazine
CID 22074529
2-(1,3-dibenzylimidazolidin-2-yl)pyridine
CID 11370900
1-[(4-chlorophenyl)methyl]-4-ethyl-2-phenylpyrrolidine
CID 173455134
1-benzyl-2-(4-methoxyphenyl)-3-[(4-nitrophenyl)methyl]imidazolidine
CID 101217629
1-benzyl-4-iodo-2-phenylpiperazine
CID 163774548
(2S)-3-benzyl-2-(4-chlorophenyl)-1,3-thiazolidin-4-one
CID 674166
(4aS,7aR)-1,4-dibenzyl-2,3,4a,5,7,7a-hexahydrothieno[3,4-b]pyrazine
CID 156507348
(2R,3R)-1-benzyl-2-(chloromethyl)-3-phenylazetidine
CID 101250941

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-3-[(4-chlorophenyl)methyl]-2-phenylimidazolidine?
The IUPAC name of 1-benzyl-3-[(4-chlorophenyl)methyl]-2-phenylimidazolidine (CID 101217631) is 1-benzyl-3-[(4-chlorophenyl)methyl]-2-phenylimidazolidine.
What is the SMILES notation for 1-benzyl-3-[(4-chlorophenyl)methyl]-2-phenylimidazolidine?
The canonical SMILES for 1-benzyl-3-[(4-chlorophenyl)methyl]-2-phenylimidazolidine is Clc1ccc(CN2CCN(Cc3ccccc3)C2c2ccccc2)cc1.
What is the InChIKey of 1-benzyl-3-[(4-chlorophenyl)methyl]-2-phenylimidazolidine?
The InChIKey is DVILMSVWCKEHFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23ClN2/c24-22-13-11-20(12-14-22)18-26-16-15-25(17-19-7-3-1-4-8-19)23(26)21-9-5-2-6-10-21/h1-14,23H,15-18H2.
What are the key properties of 1-benzyl-3-[(4-chlorophenyl)methyl]-2-phenylimidazolidine?
1-benzyl-3-[(4-chlorophenyl)methyl]-2-phenylimidazolidine has a molecular weight of 362.90 g/mol, XLogP of 5.36, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-3-[(4-chlorophenyl)methyl]-2-phenylimidazolidine is sourced from PubChem (CID 101217631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).