2-[2-(3-cyclopentyloxy-4-methoxyphenyl)-2-[4-(4-methylphenyl)phenyl]ethenyl]pyridine

C32H31NO2 — CID 67663507

IUPAC2-[2-(3-cyclopentyloxy-4-methoxyphenyl)-2-[4-(4-methylphenyl)phenyl]ethenyl]pyridine
SMILESCOc1ccc(C(=Cc2ccccn2)c2ccc(-c3ccc(C)cc3)cc2)cc1OC1CCCC1
InChIInChI=1S/C32H31NO2/c1-23-10-12-24(13-11-23)25-14-16-26(17-15-25)30(22-28-7-5-6-20-33-28)27-18-19-31(34-2)32(21-27)35-29-8-3-4-9-29/h5-7,10-22,29H,3-4,8-9H2,1-2H3
InChIKeyWXXVZCMERPXWQL-UHFFFAOYSA-N
MW461.61 g/mol
LogP7.98
Rot. Bonds7

About 2-[2-(3-cyclopentyloxy-4-methoxyphenyl)-2-[4-(4-methylphenyl)phenyl]ethenyl]pyridine

2-[2-(3-cyclopentyloxy-4-methoxyphenyl)-2-[4-(4-methylphenyl)phenyl]ethenyl]pyridine (PubChem CID 67663507) has the molecular formula C32H31NO2 and a molecular weight of 461.61 g/mol. Its IUPAC name is 2-[2-(3-cyclopentyloxy-4-methoxyphenyl)-2-[4-(4-methylphenyl)phenyl]ethenyl]pyridine.

Molecular Properties

Compound Name2-[2-(3-cyclopentyloxy-4-methoxyphenyl)-2-[4-(4-methylphenyl)phenyl]ethenyl]pyridine
PubChem CID67663507
Molecular FormulaC32H31NO2
Molecular Weight461.61 g/mol
Exact Mass461.24
IUPAC Name2-[2-(3-cyclopentyloxy-4-methoxyphenyl)-2-[4-(4-methylphenyl)phenyl]ethenyl]pyridine
SMILESCOc1ccc(C(=Cc2ccccn2)c2ccc(-c3ccc(C)cc3)cc2)cc1OC1CCCC1
InChIInChI=1S/C32H31NO2/c1-23-10-12-24(13-11-23)25-14-16-26(17-15-25)30(22-28-7-5-6-20-33-28)27-18-19-31(34-2)32(21-27)35-29-8-3-4-9-29/h5-7,10-22,29H,3-4,8-9H2,1-2H3
InChIKeyWXXVZCMERPXWQL-UHFFFAOYSA-N
XLogP7.98
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500461.61
LogP ≤ 57.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-[2-(3-cyclopentyloxy-4-methoxyphenyl)-2-[4-(4-methylphenyl)phenyl]ethenyl]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

3-[(E)-2-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenylethenyl]pyridazine
CID 19959374
4-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-pyridin-4-ylethenyl]pyridine
CID 54153043
4-[2-(3-cyclopentyloxy-4-methoxyphenyl)-2-(3-methylphenyl)ethenyl]pyridine
CID 54319505
4-[(E)-2-(4-chlorophenyl)-1-phenylethenyl]-2-cyclopentyloxy-1-methoxybenzene
CID 70076005
(3-cyclopentyloxy-4-methoxyphenyl)-pyridin-2-ylmethanone
CID 54358933
3-[2-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenylethenyl]benzoic acid
CID 54106348
ethyl 4-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-pyridin-4-ylethenyl]benzoate
CID 139988631
2-cyclopentyloxy-1-methoxy-4-methylbenzene;ethane
CID 142884364
ethyl N-[4-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-pyridin-4-ylethenyl]phenyl]carbamate
CID 54207285
benzamide;3-cyclopentyloxy-4-methoxybenzamide
CID 18691056
[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-pyridin-4-ylethenyl]-trimethylstannane
CID 70065368
4-(3-cyclopentyloxy-4-methoxyphenyl)-2-methylpyridin-3-ol
CID 57267140

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-cyclopentyloxy-4-methoxyphenyl)-2-[4-(4-methylphenyl)phenyl]ethenyl]pyridine?
The IUPAC name of 2-[2-(3-cyclopentyloxy-4-methoxyphenyl)-2-[4-(4-methylphenyl)phenyl]ethenyl]pyridine (CID 67663507) is 2-[2-(3-cyclopentyloxy-4-methoxyphenyl)-2-[4-(4-methylphenyl)phenyl]ethenyl]pyridine.
What is the SMILES notation for 2-[2-(3-cyclopentyloxy-4-methoxyphenyl)-2-[4-(4-methylphenyl)phenyl]ethenyl]pyridine?
The canonical SMILES for 2-[2-(3-cyclopentyloxy-4-methoxyphenyl)-2-[4-(4-methylphenyl)phenyl]ethenyl]pyridine is COc1ccc(C(=Cc2ccccn2)c2ccc(-c3ccc(C)cc3)cc2)cc1OC1CCCC1.
What is the InChIKey of 2-[2-(3-cyclopentyloxy-4-methoxyphenyl)-2-[4-(4-methylphenyl)phenyl]ethenyl]pyridine?
The InChIKey is WXXVZCMERPXWQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H31NO2/c1-23-10-12-24(13-11-23)25-14-16-26(17-15-25)30(22-28-7-5-6-20-33-28)27-18-19-31(34-2)32(21-27)35-29-8-3-4-9-29/h5-7,10-22,29H,3-4,8-9H2,1-2H3.
What are the key properties of 2-[2-(3-cyclopentyloxy-4-methoxyphenyl)-2-[4-(4-methylphenyl)phenyl]ethenyl]pyridine?
2-[2-(3-cyclopentyloxy-4-methoxyphenyl)-2-[4-(4-methylphenyl)phenyl]ethenyl]pyridine has a molecular weight of 461.61 g/mol, XLogP of 7.98, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-cyclopentyloxy-4-methoxyphenyl)-2-[4-(4-methylphenyl)phenyl]ethenyl]pyridine is sourced from PubChem (CID 67663507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).