2-[3-(methoxymethyl)pyrrolidin-1-yl]-1-phenylpropan-1-ol

C15H23NO2 — CID 64599486

IUPAC2-[3-(methoxymethyl)pyrrolidin-1-yl]-1-phenylpropan-1-ol
SMILESCOCC1CCN(C(C)C(O)c2ccccc2)C1
InChIInChI=1S/C15H23NO2/c1-12(15(17)14-6-4-3-5-7-14)16-9-8-13(10-16)11-18-2/h3-7,12-13,15,17H,8-11H2,1-2H3
InChIKeyQUFHGAUZYAUBHX-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.08
Rot. Bonds5

About 2-[3-(methoxymethyl)pyrrolidin-1-yl]-1-phenylpropan-1-ol

2-[3-(methoxymethyl)pyrrolidin-1-yl]-1-phenylpropan-1-ol (PubChem CID 64599486) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 2-[3-(methoxymethyl)pyrrolidin-1-yl]-1-phenylpropan-1-ol.

Molecular Properties

Compound Name2-[3-(methoxymethyl)pyrrolidin-1-yl]-1-phenylpropan-1-ol
PubChem CID64599486
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name2-[3-(methoxymethyl)pyrrolidin-1-yl]-1-phenylpropan-1-ol
SMILESCOCC1CCN(C(C)C(O)c2ccccc2)C1
InChIInChI=1S/C15H23NO2/c1-12(15(17)14-6-4-3-5-7-14)16-9-8-13(10-16)11-18-2/h3-7,12-13,15,17H,8-11H2,1-2H3
InChIKeyQUFHGAUZYAUBHX-UHFFFAOYSA-N
XLogP2.08
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-(methoxymethyl)pyrrolidin-1-yl]-1-phenylpropan-1-amine
CID 64569900
2-[3-(methoxymethyl)pyrrolidin-1-yl]-1-phenyl-N-propylpropan-1-amine
CID 64569116
2-[3-(methoxymethyl)piperidin-1-yl]-1-(4-methoxyphenyl)propan-1-ol
CID 103857720
2-[3-(methoxymethyl)pyrrolidin-1-yl]-N-methyl-2-phenylethanamine
CID 64583795
2-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-1-phenylpropan-1-ol
CID 79174920
2-[4-(methoxymethyl)piperidin-1-yl]-3-phenylbutan-1-amine
CID 63973836
3-[3-(methoxymethyl)pyrrolidin-1-yl]-3-phenylpropanenitrile
CID 64597905
2-[3-(methoxymethyl)piperidin-1-yl]-3-phenylbutan-1-amine
CID 106586416
methyl 3-[3-(methoxymethyl)pyrrolidin-1-yl]-2-methylbutanoate
CID 79414057
2-[[1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]methoxy]acetic acid
CID 18396255
4-[(2S)-2-(4-benzylpiperidin-1-yl)-1-hydroxypropyl]phenol
CID 138753340
(1R,2R)-1-phenyl-2-pyrrolidin-1-ylpropan-1-ol
CID 11830572

Frequently Asked Questions

What is the IUPAC name of 2-[3-(methoxymethyl)pyrrolidin-1-yl]-1-phenylpropan-1-ol?
The IUPAC name of 2-[3-(methoxymethyl)pyrrolidin-1-yl]-1-phenylpropan-1-ol (CID 64599486) is 2-[3-(methoxymethyl)pyrrolidin-1-yl]-1-phenylpropan-1-ol.
What is the SMILES notation for 2-[3-(methoxymethyl)pyrrolidin-1-yl]-1-phenylpropan-1-ol?
The canonical SMILES for 2-[3-(methoxymethyl)pyrrolidin-1-yl]-1-phenylpropan-1-ol is COCC1CCN(C(C)C(O)c2ccccc2)C1.
What is the InChIKey of 2-[3-(methoxymethyl)pyrrolidin-1-yl]-1-phenylpropan-1-ol?
The InChIKey is QUFHGAUZYAUBHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-12(15(17)14-6-4-3-5-7-14)16-9-8-13(10-16)11-18-2/h3-7,12-13,15,17H,8-11H2,1-2H3.
What are the key properties of 2-[3-(methoxymethyl)pyrrolidin-1-yl]-1-phenylpropan-1-ol?
2-[3-(methoxymethyl)pyrrolidin-1-yl]-1-phenylpropan-1-ol has a molecular weight of 249.35 g/mol, XLogP of 2.08, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(methoxymethyl)pyrrolidin-1-yl]-1-phenylpropan-1-ol is sourced from PubChem (CID 64599486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).