1-[(1R)-1-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-phenyl-2H-pyridine

C24H28N2O — CID 141347591

IUPAC1-[(1R)-1-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-phenyl-2H-pyridine
SMILESCOc1cccc([C@H](CN2CCCC2)N2C=CC(c3ccccc3)=CC2)c1
InChIInChI=1S/C24H28N2O/c1-27-23-11-7-10-22(18-23)24(19-25-14-5-6-15-25)26-16-12-21(13-17-26)20-8-3-2-4-9-20/h2-4,7-13,16,18,24H,5-6,14-15,17,19H2,1H3/t24-/m0/s1
InChIKeyRXHLMYLBJKDGNH-DEOSSOPVSA-N
MW360.50 g/mol
LogP4.74
Rot. Bonds6

About 1-[(1R)-1-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-phenyl-2H-pyridine

1-[(1R)-1-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-phenyl-2H-pyridine (PubChem CID 141347591) has the molecular formula C24H28N2O and a molecular weight of 360.50 g/mol. Its IUPAC name is 1-[(1R)-1-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-phenyl-2H-pyridine.

Molecular Properties

Compound Name1-[(1R)-1-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-phenyl-2H-pyridine
PubChem CID141347591
Molecular FormulaC24H28N2O
Molecular Weight360.50 g/mol
Exact Mass360.22
IUPAC Name1-[(1R)-1-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-phenyl-2H-pyridine
SMILESCOc1cccc([C@H](CN2CCCC2)N2C=CC(c3ccccc3)=CC2)c1
InChIInChI=1S/C24H28N2O/c1-27-23-11-7-10-22(18-23)24(19-25-14-5-6-15-25)26-16-12-21(13-17-26)20-8-3-2-4-9-20/h2-4,7-13,16,18,24H,5-6,14-15,17,19H2,1H3/t24-/m0/s1
InChIKeyRXHLMYLBJKDGNH-DEOSSOPVSA-N
XLogP4.74
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.50
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-methoxyphenyl)-2-(1-pyrrolidin-1-ylpropan-2-ylamino)ethanol
CID 78966951
2-[4-(3-methoxyphenyl)piperazin-1-yl]-1-phenylethanamine
CID 174368771
4-(3-methoxyphenyl)-4-piperidin-1-ylbutan-1-amine
CID 112501196
2-[4-[2-hydroxy-2-(3-methoxyphenyl)ethyl]piperazin-1-yl]cyclohepta-2,4,6-trien-1-one
CID 15592159
1-[2-amino-2-(3-methoxyphenyl)ethyl]piperidine-4-carboxamide
CID 16786895
1,3-diethyl-2-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]guanidine;hydroiodide
CID 110924791
1-(2,2-diphenylethyl)-3-(3-methoxyphenyl)piperidin-3-ol
CID 11560902
1-(3-methoxyphenyl)-2-(4-methylazepan-1-yl)ethanamine
CID 55249009
2-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-1-phenylethanol
CID 17442681
2-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-1,1,3,3-tetramethylguanidine
CID 111030442
1,3-bis[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]urea
CID 24658456
1-(2-methoxy-2-phenylethyl)-3-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-2-methylguanidine
CID 111347015

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-1-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-phenyl-2H-pyridine?
The IUPAC name of 1-[(1R)-1-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-phenyl-2H-pyridine (CID 141347591) is 1-[(1R)-1-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-phenyl-2H-pyridine.
What is the SMILES notation for 1-[(1R)-1-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-phenyl-2H-pyridine?
The canonical SMILES for 1-[(1R)-1-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-phenyl-2H-pyridine is COc1cccc([C@H](CN2CCCC2)N2C=CC(c3ccccc3)=CC2)c1.
What is the InChIKey of 1-[(1R)-1-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-phenyl-2H-pyridine?
The InChIKey is RXHLMYLBJKDGNH-DEOSSOPVSA-N. The full InChI is InChI=1S/C24H28N2O/c1-27-23-11-7-10-22(18-23)24(19-25-14-5-6-15-25)26-16-12-21(13-17-26)20-8-3-2-4-9-20/h2-4,7-13,16,18,24H,5-6,14-15,17,19H2,1H3/t24-/m0/s1.
What are the key properties of 1-[(1R)-1-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-phenyl-2H-pyridine?
1-[(1R)-1-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-phenyl-2H-pyridine has a molecular weight of 360.50 g/mol, XLogP of 4.74, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-1-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-phenyl-2H-pyridine is sourced from PubChem (CID 141347591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).