(4R,5R)-2-cyclohexyl-4,5-diphenylimidazolidine

C21H26N2 — CID 69477253

IUPAC(4R,5R)-2-cyclohexyl-4,5-diphenylimidazolidine
SMILESc1ccc([C@H]2NC(C3CCCCC3)N[C@@H]2c2ccccc2)cc1
InChIInChI=1S/C21H26N2/c1-4-10-16(11-5-1)19-20(17-12-6-2-7-13-17)23-21(22-19)18-14-8-3-9-15-18/h1-2,4-7,10-13,18-23H,3,8-9,14-15H2/t19-,20-/m1/s1
InChIKeyCIIHZUZHYWRJBU-WOJBJXKFSA-N
MW306.45 g/mol
LogP4.57
Rot. Bonds3

About (4R,5R)-2-cyclohexyl-4,5-diphenylimidazolidine

(4R,5R)-2-cyclohexyl-4,5-diphenylimidazolidine (PubChem CID 69477253) has the molecular formula C21H26N2 and a molecular weight of 306.45 g/mol. Its IUPAC name is (4R,5R)-2-cyclohexyl-4,5-diphenylimidazolidine.

Molecular Properties

Compound Name(4R,5R)-2-cyclohexyl-4,5-diphenylimidazolidine
PubChem CID69477253
Molecular FormulaC21H26N2
Molecular Weight306.45 g/mol
Exact Mass306.21
IUPAC Name(4R,5R)-2-cyclohexyl-4,5-diphenylimidazolidine
SMILESc1ccc([C@H]2NC(C3CCCCC3)N[C@@H]2c2ccccc2)cc1
InChIInChI=1S/C21H26N2/c1-4-10-16(11-5-1)19-20(17-12-6-2-7-13-17)23-21(22-19)18-14-8-3-9-15-18/h1-2,4-7,10-13,18-23H,3,8-9,14-15H2/t19-,20-/m1/s1
InChIKeyCIIHZUZHYWRJBU-WOJBJXKFSA-N
XLogP4.57
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.45
LogP ≤ 54.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-phenyl-2-azabicyclo[2.2.1]heptane
CID 84766510
2-cyclohexyl-4-phenylpiperidine
CID 57496384
CID 159076923
CID 159076923
(5R,6S)-3-cyclohexyl-5-methyl-6-phenylmorpholin-2-one
CID 102533542
benzene;cyclohexylcyclohexane
CID 160520949
1,2,3,4,5,5a,6,7,8,9,10,10a-dodecahydroheptalene;biphenylene
CID 161014557
(2S,3S)-3-fluoro-2-phenylpiperidine
CID 167716919
cyclohexylbenzene;hydrogen peroxide;hydrate
CID 174910153
cyclohexyl(phenyl)iodanium
CID 87308360
3,3-dimethyl-22-phenyl-21-azabicyclo[17.3.0]docosane
CID 155394921
2-phenyl-2,4,4a,5,6,7,8,8a-octahydro-1H-benzo[d][1,3]oxazine
CID 571843
(4R,5R)-2-cyclohexyl-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 102198802

Frequently Asked Questions

What is the IUPAC name of (4R,5R)-2-cyclohexyl-4,5-diphenylimidazolidine?
The IUPAC name of (4R,5R)-2-cyclohexyl-4,5-diphenylimidazolidine (CID 69477253) is (4R,5R)-2-cyclohexyl-4,5-diphenylimidazolidine.
What is the SMILES notation for (4R,5R)-2-cyclohexyl-4,5-diphenylimidazolidine?
The canonical SMILES for (4R,5R)-2-cyclohexyl-4,5-diphenylimidazolidine is c1ccc([C@H]2NC(C3CCCCC3)N[C@@H]2c2ccccc2)cc1.
What is the InChIKey of (4R,5R)-2-cyclohexyl-4,5-diphenylimidazolidine?
The InChIKey is CIIHZUZHYWRJBU-WOJBJXKFSA-N. The full InChI is InChI=1S/C21H26N2/c1-4-10-16(11-5-1)19-20(17-12-6-2-7-13-17)23-21(22-19)18-14-8-3-9-15-18/h1-2,4-7,10-13,18-23H,3,8-9,14-15H2/t19-,20-/m1/s1.
What are the key properties of (4R,5R)-2-cyclohexyl-4,5-diphenylimidazolidine?
(4R,5R)-2-cyclohexyl-4,5-diphenylimidazolidine has a molecular weight of 306.45 g/mol, XLogP of 4.57, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,5R)-2-cyclohexyl-4,5-diphenylimidazolidine is sourced from PubChem (CID 69477253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).