2-[(1R,2R)-1,2-bis(4-ethylphenyl)-2-pyridin-2-ylethyl]pyridine

C28H28N2 — CID 134852972

IUPAC2-[(1R,2R)-1,2-bis(4-ethylphenyl)-2-pyridin-2-ylethyl]pyridine
SMILESCCc1ccc([C@H](c2ccccn2)[C@H](c2ccc(CC)cc2)c2ccccn2)cc1
InChIInChI=1S/C28H28N2/c1-3-21-11-15-23(16-12-21)27(25-9-5-7-19-29-25)28(26-10-6-8-20-30-26)24-17-13-22(4-2)14-18-24/h5-20,27-28H,3-4H2,1-2H3/t27-,28-/m1/s1
InChIKeyFTNTZGQGOOVFEE-VSGBNLITSA-N
MW392.55 g/mol
LogP6.57
Rot. Bonds7

About 2-[(1R,2R)-1,2-bis(4-ethylphenyl)-2-pyridin-2-ylethyl]pyridine

2-[(1R,2R)-1,2-bis(4-ethylphenyl)-2-pyridin-2-ylethyl]pyridine (PubChem CID 134852972) has the molecular formula C28H28N2 and a molecular weight of 392.55 g/mol. Its IUPAC name is 2-[(1R,2R)-1,2-bis(4-ethylphenyl)-2-pyridin-2-ylethyl]pyridine.

Molecular Properties

Compound Name2-[(1R,2R)-1,2-bis(4-ethylphenyl)-2-pyridin-2-ylethyl]pyridine
PubChem CID134852972
Molecular FormulaC28H28N2
Molecular Weight392.55 g/mol
Exact Mass392.23
IUPAC Name2-[(1R,2R)-1,2-bis(4-ethylphenyl)-2-pyridin-2-ylethyl]pyridine
SMILESCCc1ccc([C@H](c2ccccn2)[C@H](c2ccc(CC)cc2)c2ccccn2)cc1
InChIInChI=1S/C28H28N2/c1-3-21-11-15-23(16-12-21)27(25-9-5-7-19-29-25)28(26-10-6-8-20-30-26)24-17-13-22(4-2)14-18-24/h5-20,27-28H,3-4H2,1-2H3/t27-,28-/m1/s1
InChIKeyFTNTZGQGOOVFEE-VSGBNLITSA-N
XLogP6.57
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.55
LogP ≤ 56.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-[(1R,2R)-1,2-bis(4-ethylphenyl)-2-pyridin-2-ylethyl]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(4-ethylphenyl)-pyridin-2-ylmethyl]ethanamine
CID 55084696
2-[1-(4-fluorophenyl)-2-methylpropyl]pyridine
CID 146530371
1-(4-ethylphenyl)-3-pyridin-2-ylpropan-1-amine
CID 105121774
ethane;2-pentan-3-ylpyridine
CID 142883968
ethane;2-(1-phenylethyl)pyridine
CID 143899083
(S)-(2-ethylphenyl)-pyridin-2-ylmethanol
CID 97292894
2-(4-ethylphenyl)-2-pyrimidin-2-ylacetonitrile
CID 116833422
(R)-(2-ethylphenyl)-pyridin-2-ylmethanol
CID 97292895
2-methyl-1-pyridin-2-ylbutan-1-ol
CID 79444533
ethane;5-ethyl-2-pyridin-2-ylpyridine
CID 143067787
1-[4-(2-methylpropyl)phenyl]-N-[(1S)-1-pyridin-2-ylethyl]ethanamine
CID 81392625
2-[3-(dimethylamino)-1-phenyl-1-pyridin-2-ylpropan-2-yl]oxy-N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine
CID 68666892

Frequently Asked Questions

What is the IUPAC name of 2-[(1R,2R)-1,2-bis(4-ethylphenyl)-2-pyridin-2-ylethyl]pyridine?
The IUPAC name of 2-[(1R,2R)-1,2-bis(4-ethylphenyl)-2-pyridin-2-ylethyl]pyridine (CID 134852972) is 2-[(1R,2R)-1,2-bis(4-ethylphenyl)-2-pyridin-2-ylethyl]pyridine.
What is the SMILES notation for 2-[(1R,2R)-1,2-bis(4-ethylphenyl)-2-pyridin-2-ylethyl]pyridine?
The canonical SMILES for 2-[(1R,2R)-1,2-bis(4-ethylphenyl)-2-pyridin-2-ylethyl]pyridine is CCc1ccc([C@H](c2ccccn2)[C@H](c2ccc(CC)cc2)c2ccccn2)cc1.
What is the InChIKey of 2-[(1R,2R)-1,2-bis(4-ethylphenyl)-2-pyridin-2-ylethyl]pyridine?
The InChIKey is FTNTZGQGOOVFEE-VSGBNLITSA-N. The full InChI is InChI=1S/C28H28N2/c1-3-21-11-15-23(16-12-21)27(25-9-5-7-19-29-25)28(26-10-6-8-20-30-26)24-17-13-22(4-2)14-18-24/h5-20,27-28H,3-4H2,1-2H3/t27-,28-/m1/s1.
What are the key properties of 2-[(1R,2R)-1,2-bis(4-ethylphenyl)-2-pyridin-2-ylethyl]pyridine?
2-[(1R,2R)-1,2-bis(4-ethylphenyl)-2-pyridin-2-ylethyl]pyridine has a molecular weight of 392.55 g/mol, XLogP of 6.57, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1R,2R)-1,2-bis(4-ethylphenyl)-2-pyridin-2-ylethyl]pyridine is sourced from PubChem (CID 134852972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).