2-[1-[(4S,5R)-4,5-diphenyl-4,5-dihydro-1H-imidazol-2-yl]ethyl]pyridine

C22H21N3 — CID 68568343

IUPAC2-[1-[(4S,5R)-4,5-diphenyl-4,5-dihydro-1H-imidazol-2-yl]ethyl]pyridine
SMILESCC(C1=N[C@@H](c2ccccc2)[C@@H](c2ccccc2)N1)c1ccccn1
InChIInChI=1S/C22H21N3/c1-16(19-14-8-9-15-23-19)22-24-20(17-10-4-2-5-11-17)21(25-22)18-12-6-3-7-13-18/h2-16,20-21H,1H3,(H,24,25)/t16?,20-,21+
InChIKeyZRPJXPXTPBBEMX-QKUVIELKSA-N
MW327.43 g/mol
LogP4.67
Rot. Bonds4

About 2-[1-[(4S,5R)-4,5-diphenyl-4,5-dihydro-1H-imidazol-2-yl]ethyl]pyridine

2-[1-[(4S,5R)-4,5-diphenyl-4,5-dihydro-1H-imidazol-2-yl]ethyl]pyridine (PubChem CID 68568343) has the molecular formula C22H21N3 and a molecular weight of 327.43 g/mol. Its IUPAC name is 2-[1-[(4S,5R)-4,5-diphenyl-4,5-dihydro-1H-imidazol-2-yl]ethyl]pyridine.

Molecular Properties

Compound Name2-[1-[(4S,5R)-4,5-diphenyl-4,5-dihydro-1H-imidazol-2-yl]ethyl]pyridine
PubChem CID68568343
Molecular FormulaC22H21N3
Molecular Weight327.43 g/mol
Exact Mass327.17
IUPAC Name2-[1-[(4S,5R)-4,5-diphenyl-4,5-dihydro-1H-imidazol-2-yl]ethyl]pyridine
SMILESCC(C1=N[C@@H](c2ccccc2)[C@@H](c2ccccc2)N1)c1ccccn1
InChIInChI=1S/C22H21N3/c1-16(19-14-8-9-15-23-19)22-24-20(17-10-4-2-5-11-17)21(25-22)18-12-6-3-7-13-18/h2-16,20-21H,1H3,(H,24,25)/t16?,20-,21+
InChIKeyZRPJXPXTPBBEMX-QKUVIELKSA-N
XLogP4.67
TPSA37.28 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(4-chlorophenyl)ethyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 68566282
ethane;2-(1-phenylethyl)pyridine
CID 143899083
(4S,5S)-1-deuterio-2-(1-deuterio-1-phenylethyl)-4,5-diphenyl-4,5-dihydroimidazole
CID 10592398
(1S)-N-(dicyclopropylmethyl)-1-pyridin-2-ylethanamine
CID 28660896
2-(dipyridin-2-ylmethyl)pyridine
CID 10332212
(4S,5R)-2-[[(4S,5R)-4,5-diphenyl-4,5-dihydro-1H-imidazol-2-yl]methylsulfanylmethyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 91220935
2-benzyl-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 68573876
1-oxido-2-(1-pyridin-2-ylethyl)pyridin-1-ium
CID 90911771
1-pyridin-2-yl-2-[2-(1-sulfanylethyl)-4,5-dihydro-1H-imidazol-5-yl]ethanethiol
CID 163606265
2-[(2R)-3-methylbutan-2-yl]pyridine
CID 26793118
ethane;2-methylpropane;2-propan-2-ylpyridine
CID 160963174
N-[(1S)-1-pyridin-2-ylethyl]piperidin-4-amine
CID 81401330

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(4S,5R)-4,5-diphenyl-4,5-dihydro-1H-imidazol-2-yl]ethyl]pyridine?
The IUPAC name of 2-[1-[(4S,5R)-4,5-diphenyl-4,5-dihydro-1H-imidazol-2-yl]ethyl]pyridine (CID 68568343) is 2-[1-[(4S,5R)-4,5-diphenyl-4,5-dihydro-1H-imidazol-2-yl]ethyl]pyridine.
What is the SMILES notation for 2-[1-[(4S,5R)-4,5-diphenyl-4,5-dihydro-1H-imidazol-2-yl]ethyl]pyridine?
The canonical SMILES for 2-[1-[(4S,5R)-4,5-diphenyl-4,5-dihydro-1H-imidazol-2-yl]ethyl]pyridine is CC(C1=N[C@@H](c2ccccc2)[C@@H](c2ccccc2)N1)c1ccccn1.
What is the InChIKey of 2-[1-[(4S,5R)-4,5-diphenyl-4,5-dihydro-1H-imidazol-2-yl]ethyl]pyridine?
The InChIKey is ZRPJXPXTPBBEMX-QKUVIELKSA-N. The full InChI is InChI=1S/C22H21N3/c1-16(19-14-8-9-15-23-19)22-24-20(17-10-4-2-5-11-17)21(25-22)18-12-6-3-7-13-18/h2-16,20-21H,1H3,(H,24,25)/t16?,20-,21+.
What are the key properties of 2-[1-[(4S,5R)-4,5-diphenyl-4,5-dihydro-1H-imidazol-2-yl]ethyl]pyridine?
2-[1-[(4S,5R)-4,5-diphenyl-4,5-dihydro-1H-imidazol-2-yl]ethyl]pyridine has a molecular weight of 327.43 g/mol, XLogP of 4.67, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(4S,5R)-4,5-diphenyl-4,5-dihydro-1H-imidazol-2-yl]ethyl]pyridine is sourced from PubChem (CID 68568343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).