[4-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]phenyl]methanol

C19H23NO2 — CID 110008065

IUPAC[4-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]phenyl]methanol
SMILESCOc1ccc(C2CCCN2Cc2ccc(CO)cc2)cc1
InChIInChI=1S/C19H23NO2/c1-22-18-10-8-17(9-11-18)19-3-2-12-20(19)13-15-4-6-16(14-21)7-5-15/h4-11,19,21H,2-3,12-14H2,1H3
InChIKeyXDIRWCFFBXDWFY-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.52
Rot. Bonds5

About [4-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]phenyl]methanol

[4-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]phenyl]methanol (PubChem CID 110008065) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is [4-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]phenyl]methanol.

Molecular Properties

Compound Name[4-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]phenyl]methanol
PubChem CID110008065
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name[4-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]phenyl]methanol
SMILESCOc1ccc(C2CCCN2Cc2ccc(CO)cc2)cc1
InChIInChI=1S/C19H23NO2/c1-22-18-10-8-17(9-11-18)19-3-2-12-20(19)13-15-4-6-16(14-21)7-5-15/h4-11,19,21H,2-3,12-14H2,1H3
InChIKeyXDIRWCFFBXDWFY-UHFFFAOYSA-N
XLogP3.52
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]pyrrolidine
CID 20895862
4-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]pyridine
CID 127245045
(2R)-1-ethyl-2-(4-methoxyphenyl)pyrrolidine
CID 124500800
1-[(3-fluorophenyl)methyl]-2-(4-methoxyphenyl)pyrrolidine
CID 20895836
1-[(4-methoxy-3-nitrophenyl)methyl]-2-(4-methoxyphenyl)pyrrolidine
CID 87013517
(2S)-1-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-2-(4-methoxyphenyl)pyrrolidine
CID 29233775
1-[[4-(difluoromethylsulfonyl)phenyl]methyl]-2-(4-methoxyphenyl)azepane
CID 112803307
3-[(2S)-1-[(4-methoxyphenyl)methyl]piperidin-2-yl]pyridine
CID 872941
2-(4-methoxyphenyl)-1-[(3-nitrophenyl)methyl]pyrrolidine
CID 46266484
2-[2-[4-(4-methoxyphenoxy)phenyl]pyrrolidin-1-yl]acetic acid
CID 24845352
5-[[(2S)-2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]-1H-pyrazole
CID 124591281
cycloheptane;(4-methoxyphenyl)methanol
CID 142801335

Frequently Asked Questions

What is the IUPAC name of [4-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]phenyl]methanol?
The IUPAC name of [4-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]phenyl]methanol (CID 110008065) is [4-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]phenyl]methanol.
What is the SMILES notation for [4-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]phenyl]methanol?
The canonical SMILES for [4-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]phenyl]methanol is COc1ccc(C2CCCN2Cc2ccc(CO)cc2)cc1.
What is the InChIKey of [4-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]phenyl]methanol?
The InChIKey is XDIRWCFFBXDWFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-22-18-10-8-17(9-11-18)19-3-2-12-20(19)13-15-4-6-16(14-21)7-5-15/h4-11,19,21H,2-3,12-14H2,1H3.
What are the key properties of [4-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]phenyl]methanol?
[4-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]phenyl]methanol has a molecular weight of 297.40 g/mol, XLogP of 3.52, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]phenyl]methanol is sourced from PubChem (CID 110008065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).