2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]ethanol

C14H22N2O — CID 61212508

IUPAC2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]ethanol
SMILESOCCNC1CCN(CCc2ccccc2)C1
InChIInChI=1S/C14H22N2O/c17-11-8-15-14-7-10-16(12-14)9-6-13-4-2-1-3-5-13/h1-5,14-15,17H,6-12H2
InChIKeyOIPIKDCNEXKAIW-UHFFFAOYSA-N
MW234.34 g/mol
LogP0.89
Rot. Bonds6

About 2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]ethanol

2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]ethanol (PubChem CID 61212508) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]ethanol.

Molecular Properties

Compound Name2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]ethanol
PubChem CID61212508
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]ethanol
SMILESOCCNC1CCN(CCc2ccccc2)C1
InChIInChI=1S/C14H22N2O/c17-11-8-15-14-7-10-16(12-14)9-6-13-4-2-1-3-5-13/h1-5,14-15,17H,6-12H2
InChIKeyOIPIKDCNEXKAIW-UHFFFAOYSA-N
XLogP0.89
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]hexan-1-ol
CID 103922220
N,1-bis(2-phenylethyl)piperidin-4-amine
CID 24785666
5-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]pentan-2-ol
CID 107267756
1-(2-phenylethyl)-N-prop-2-ynylpyrrolidin-3-amine
CID 61211753
1-phenyl-2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]ethanol
CID 110901793
N-methyl-2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide
CID 61212881
N-(2,3-dimethylbutyl)-1-(2-phenylethyl)pyrrolidin-3-amine
CID 64570465
(2R)-2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]propan-1-ol
CID 114986909
N-(2,2-dimethoxyethyl)-1-(2-phenylethyl)pyrrolidin-3-amine
CID 61212133
1,1-dimethyl-2-[1-(2-phenylethyl)pyrrolidin-3-yl]hydrazine
CID 83004992
N-[2-(4-chlorophenyl)ethyl]-1-(2-phenylethyl)piperidin-4-amine
CID 30983457
2-methyl-3-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]butan-1-ol
CID 115677253

Frequently Asked Questions

What is the IUPAC name of 2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]ethanol?
The IUPAC name of 2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]ethanol (CID 61212508) is 2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]ethanol.
What is the SMILES notation for 2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]ethanol?
The canonical SMILES for 2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]ethanol is OCCNC1CCN(CCc2ccccc2)C1.
What is the InChIKey of 2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]ethanol?
The InChIKey is OIPIKDCNEXKAIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c17-11-8-15-14-7-10-16(12-14)9-6-13-4-2-1-3-5-13/h1-5,14-15,17H,6-12H2.
What are the key properties of 2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]ethanol?
2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]ethanol has a molecular weight of 234.34 g/mol, XLogP of 0.89, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]ethanol is sourced from PubChem (CID 61212508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).