(4R)-4-phenyl-1,3-bis(2-propan-2-ylphenyl)imidazolidine

C27H32N2 — CID 59047507

IUPAC(4R)-4-phenyl-1,3-bis(2-propan-2-ylphenyl)imidazolidine
SMILESCC(C)c1ccccc1N1C[C@@H](c2ccccc2)N(c2ccccc2C(C)C)C1
InChIInChI=1S/C27H32N2/c1-20(2)23-14-8-10-16-25(23)28-18-27(22-12-6-5-7-13-22)29(19-28)26-17-11-9-15-24(26)21(3)4/h5-17,20-21,27H,18-19H2,1-4H3/t27-/m0/s1
InChIKeyVEBVUUILHHQPMV-MHZLTWQESA-N
MW384.57 g/mol
LogP6.96
Rot. Bonds5

About (4R)-4-phenyl-1,3-bis(2-propan-2-ylphenyl)imidazolidine

(4R)-4-phenyl-1,3-bis(2-propan-2-ylphenyl)imidazolidine (PubChem CID 59047507) has the molecular formula C27H32N2 and a molecular weight of 384.57 g/mol. Its IUPAC name is (4R)-4-phenyl-1,3-bis(2-propan-2-ylphenyl)imidazolidine.

Molecular Properties

Compound Name(4R)-4-phenyl-1,3-bis(2-propan-2-ylphenyl)imidazolidine
PubChem CID59047507
Molecular FormulaC27H32N2
Molecular Weight384.57 g/mol
Exact Mass384.26
IUPAC Name(4R)-4-phenyl-1,3-bis(2-propan-2-ylphenyl)imidazolidine
SMILESCC(C)c1ccccc1N1C[C@@H](c2ccccc2)N(c2ccccc2C(C)C)C1
InChIInChI=1S/C27H32N2/c1-20(2)23-14-8-10-16-25(23)28-18-27(22-12-6-5-7-13-22)29(19-28)26-17-11-9-15-24(26)21(3)4/h5-17,20-21,27H,18-19H2,1-4H3/t27-/m0/s1
InChIKeyVEBVUUILHHQPMV-MHZLTWQESA-N
XLogP6.96
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.57
LogP ≤ 56.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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N-methyl-1-[2-(3-phenylazetidin-1-yl)phenyl]ethanamine
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[1-(2-propan-2-ylphenyl)pyrrolidin-3-yl]methanol
CID 53215506
4,4-difluoro-1-(2-propan-2-ylphenyl)piperidine
CID 117007764
2-phenyl-1-propan-2-yl-2,3-dihydroindole
CID 139389323
2-[1-(2-propan-2-ylphenyl)pyrrolidin-3-yl]ethanol
CID 117028454
1-[2-(3,4,5-trimethylpiperazin-1-yl)phenyl]ethanamine
CID 114538247
3,3-dimethyl-1-(2-propan-2-ylphenyl)pyrrolidine
CID 174262939
3-(2-methylpropyl)-1-(2-propan-2-ylphenyl)piperazine
CID 64923787
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CID 117022435

Frequently Asked Questions

What is the IUPAC name of (4R)-4-phenyl-1,3-bis(2-propan-2-ylphenyl)imidazolidine?
The IUPAC name of (4R)-4-phenyl-1,3-bis(2-propan-2-ylphenyl)imidazolidine (CID 59047507) is (4R)-4-phenyl-1,3-bis(2-propan-2-ylphenyl)imidazolidine.
What is the SMILES notation for (4R)-4-phenyl-1,3-bis(2-propan-2-ylphenyl)imidazolidine?
The canonical SMILES for (4R)-4-phenyl-1,3-bis(2-propan-2-ylphenyl)imidazolidine is CC(C)c1ccccc1N1C[C@@H](c2ccccc2)N(c2ccccc2C(C)C)C1.
What is the InChIKey of (4R)-4-phenyl-1,3-bis(2-propan-2-ylphenyl)imidazolidine?
The InChIKey is VEBVUUILHHQPMV-MHZLTWQESA-N. The full InChI is InChI=1S/C27H32N2/c1-20(2)23-14-8-10-16-25(23)28-18-27(22-12-6-5-7-13-22)29(19-28)26-17-11-9-15-24(26)21(3)4/h5-17,20-21,27H,18-19H2,1-4H3/t27-/m0/s1.
What are the key properties of (4R)-4-phenyl-1,3-bis(2-propan-2-ylphenyl)imidazolidine?
(4R)-4-phenyl-1,3-bis(2-propan-2-ylphenyl)imidazolidine has a molecular weight of 384.57 g/mol, XLogP of 6.96, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-phenyl-1,3-bis(2-propan-2-ylphenyl)imidazolidine is sourced from PubChem (CID 59047507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).