[1-[2-(dimethylamino)phenyl]pyrrolidin-3-yl]methanol

C13H20N2O — CID 106760827

IUPAC[1-[2-(dimethylamino)phenyl]pyrrolidin-3-yl]methanol
SMILESCN(C)c1ccccc1N1CCC(CO)C1
InChIInChI=1S/C13H20N2O/c1-14(2)12-5-3-4-6-13(12)15-8-7-11(9-15)10-16/h3-6,11,16H,7-10H2,1-2H3
InChIKeyMIVSURTWTBAMOY-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.57
Rot. Bonds3

About [1-[2-(dimethylamino)phenyl]pyrrolidin-3-yl]methanol

[1-[2-(dimethylamino)phenyl]pyrrolidin-3-yl]methanol (PubChem CID 106760827) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is [1-[2-(dimethylamino)phenyl]pyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[1-[2-(dimethylamino)phenyl]pyrrolidin-3-yl]methanol
PubChem CID106760827
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name[1-[2-(dimethylamino)phenyl]pyrrolidin-3-yl]methanol
SMILESCN(C)c1ccccc1N1CCC(CO)C1
InChIInChI=1S/C13H20N2O/c1-14(2)12-5-3-4-6-13(12)15-8-7-11(9-15)10-16/h3-6,11,16H,7-10H2,1-2H3
InChIKeyMIVSURTWTBAMOY-UHFFFAOYSA-N
XLogP1.57
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-[2-(dimethylamino)phenyl]pyrrolidin-3-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [1-[2-(dimethylamino)phenyl]pyrrolidin-3-yl]methanol?
The IUPAC name of [1-[2-(dimethylamino)phenyl]pyrrolidin-3-yl]methanol (CID 106760827) is [1-[2-(dimethylamino)phenyl]pyrrolidin-3-yl]methanol.
What is the SMILES notation for [1-[2-(dimethylamino)phenyl]pyrrolidin-3-yl]methanol?
The canonical SMILES for [1-[2-(dimethylamino)phenyl]pyrrolidin-3-yl]methanol is CN(C)c1ccccc1N1CCC(CO)C1.
What is the InChIKey of [1-[2-(dimethylamino)phenyl]pyrrolidin-3-yl]methanol?
The InChIKey is MIVSURTWTBAMOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-14(2)12-5-3-4-6-13(12)15-8-7-11(9-15)10-16/h3-6,11,16H,7-10H2,1-2H3.
What are the key properties of [1-[2-(dimethylamino)phenyl]pyrrolidin-3-yl]methanol?
[1-[2-(dimethylamino)phenyl]pyrrolidin-3-yl]methanol has a molecular weight of 220.32 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-(dimethylamino)phenyl]pyrrolidin-3-yl]methanol is sourced from PubChem (CID 106760827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).