4-[(2R)-2-(4-methoxy-3-phenoxyphenyl)-2-phenylethyl]pyridine

C26H23NO2 — CID 20662659

IUPAC4-[(2R)-2-(4-methoxy-3-phenoxyphenyl)-2-phenylethyl]pyridine
SMILESCOc1ccc([C@H](Cc2ccncc2)c2ccccc2)cc1Oc1ccccc1
InChIInChI=1S/C26H23NO2/c1-28-25-13-12-22(19-26(25)29-23-10-6-3-7-11-23)24(21-8-4-2-5-9-21)18-20-14-16-27-17-15-20/h2-17,19,24H,18H2,1H3/t24-/m1/s1
InChIKeyIGQFLULRXLVAMT-XMMPIXPASA-N
MW381.48 g/mol
LogP6.26
Rot. Bonds7

About 4-[(2R)-2-(4-methoxy-3-phenoxyphenyl)-2-phenylethyl]pyridine

4-[(2R)-2-(4-methoxy-3-phenoxyphenyl)-2-phenylethyl]pyridine (PubChem CID 20662659) has the molecular formula C26H23NO2 and a molecular weight of 381.48 g/mol. Its IUPAC name is 4-[(2R)-2-(4-methoxy-3-phenoxyphenyl)-2-phenylethyl]pyridine.

Molecular Properties

Compound Name4-[(2R)-2-(4-methoxy-3-phenoxyphenyl)-2-phenylethyl]pyridine
PubChem CID20662659
Molecular FormulaC26H23NO2
Molecular Weight381.48 g/mol
Exact Mass381.17
IUPAC Name4-[(2R)-2-(4-methoxy-3-phenoxyphenyl)-2-phenylethyl]pyridine
SMILESCOc1ccc([C@H](Cc2ccncc2)c2ccccc2)cc1Oc1ccccc1
InChIInChI=1S/C26H23NO2/c1-28-25-13-12-22(19-26(25)29-23-10-6-3-7-11-23)24(21-8-4-2-5-9-21)18-20-14-16-27-17-15-20/h2-17,19,24H,18H2,1H3/t24-/m1/s1
InChIKeyIGQFLULRXLVAMT-XMMPIXPASA-N
XLogP6.26
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500381.48
LogP ≤ 56.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-(3-cyclopentyloxy-4-methoxyphenyl)-2-[4-(methoxymethyl)phenyl]ethyl]pyridine
CID 54365893
N-[4-[1-[3-(2,3-dihydro-1H-inden-2-yloxy)-4-methoxyphenyl]-2-pyridin-4-ylethyl]phenyl]-1-phenylmethanesulfonamide
CID 70082847
2-[4-[(1R)-1-(3-cyclopentyloxy-4-methoxyphenyl)-2-pyridin-4-ylethyl]phenyl]ethanol
CID 70066578
N-[3-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-pyridin-4-ylethyl]phenyl]-1-phenylmethanesulfonamide
CID 21360946
N-(benzenesulfonyl)-4-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-pyridin-4-ylethyl]benzamide
CID 19707450
1-(3,4-dimethoxyphenyl)-N-(pyridin-4-ylmethyl)propan-1-amine
CID 43204862
5-[1-[3,4-bis(difluoromethoxy)phenyl]-2-pyridin-4-ylethyl]-N-[(1R)-1-phenylethyl]pyridin-2-amine
CID 70223317
1-[3-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-pyridin-4-ylethyl]phenyl]-3-ethylurea
CID 73086463
3-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenyl-4-pyridin-4-ylbutanoic acid
CID 67654163
4-[2-bromo-2-(3-bromo-4-methoxyphenyl)ethyl]pyridine
CID 66455485
(1R)-2-[[(1R)-1-(3,4-dimethoxyphenyl)-2-phenylethyl]amino]-1-pyridin-3-ylethanol
CID 22881914
2-[4-[(1R)-1-(3-cyclopentyloxy-4-methoxyphenyl)-2-pyridin-4-ylethyl]phenyl]-2-oxoethanesulfonamide
CID 140672553

Frequently Asked Questions

What is the IUPAC name of 4-[(2R)-2-(4-methoxy-3-phenoxyphenyl)-2-phenylethyl]pyridine?
The IUPAC name of 4-[(2R)-2-(4-methoxy-3-phenoxyphenyl)-2-phenylethyl]pyridine (CID 20662659) is 4-[(2R)-2-(4-methoxy-3-phenoxyphenyl)-2-phenylethyl]pyridine.
What is the SMILES notation for 4-[(2R)-2-(4-methoxy-3-phenoxyphenyl)-2-phenylethyl]pyridine?
The canonical SMILES for 4-[(2R)-2-(4-methoxy-3-phenoxyphenyl)-2-phenylethyl]pyridine is COc1ccc([C@H](Cc2ccncc2)c2ccccc2)cc1Oc1ccccc1.
What is the InChIKey of 4-[(2R)-2-(4-methoxy-3-phenoxyphenyl)-2-phenylethyl]pyridine?
The InChIKey is IGQFLULRXLVAMT-XMMPIXPASA-N. The full InChI is InChI=1S/C26H23NO2/c1-28-25-13-12-22(19-26(25)29-23-10-6-3-7-11-23)24(21-8-4-2-5-9-21)18-20-14-16-27-17-15-20/h2-17,19,24H,18H2,1H3/t24-/m1/s1.
What are the key properties of 4-[(2R)-2-(4-methoxy-3-phenoxyphenyl)-2-phenylethyl]pyridine?
4-[(2R)-2-(4-methoxy-3-phenoxyphenyl)-2-phenylethyl]pyridine has a molecular weight of 381.48 g/mol, XLogP of 6.26, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2R)-2-(4-methoxy-3-phenoxyphenyl)-2-phenylethyl]pyridine is sourced from PubChem (CID 20662659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).