(1R)-1-[2-(3,4-dimethylpyrrolidin-1-yl)phenyl]ethanol

C14H21NO — CID 79188358

IUPAC(1R)-1-[2-(3,4-dimethylpyrrolidin-1-yl)phenyl]ethanol
SMILESCC1CN(c2ccccc2[C@@H](C)O)CC1C
InChIInChI=1S/C14H21NO/c1-10-8-15(9-11(10)2)14-7-5-4-6-13(14)12(3)16/h4-7,10-12,16H,8-9H2,1-3H3/t10?,11?,12-/m1/s1
InChIKeyATDIFFSVWNBYDT-HTAVTVPLSA-N
MW219.33 g/mol
LogP2.83
Rot. Bonds2

About (1R)-1-[2-(3,4-dimethylpyrrolidin-1-yl)phenyl]ethanol

(1R)-1-[2-(3,4-dimethylpyrrolidin-1-yl)phenyl]ethanol (PubChem CID 79188358) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is (1R)-1-[2-(3,4-dimethylpyrrolidin-1-yl)phenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[2-(3,4-dimethylpyrrolidin-1-yl)phenyl]ethanol
PubChem CID79188358
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name(1R)-1-[2-(3,4-dimethylpyrrolidin-1-yl)phenyl]ethanol
SMILESCC1CN(c2ccccc2[C@@H](C)O)CC1C
InChIInChI=1S/C14H21NO/c1-10-8-15(9-11(10)2)14-7-5-4-6-13(14)12(3)16/h4-7,10-12,16H,8-9H2,1-3H3/t10?,11?,12-/m1/s1
InChIKeyATDIFFSVWNBYDT-HTAVTVPLSA-N
XLogP2.83
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (1R)-1-[2-(3,4-dimethylpyrrolidin-1-yl)phenyl]ethanol with MolForge

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

Launch Full Analysis

Related Compounds

1-[2-(3-propylazetidin-1-yl)phenyl]ethanol
CID 104549305
(1S)-1-[2-(3,4-dimethylpiperazin-1-yl)phenyl]ethanol
CID 63610426
1-[5-bromo-2-(3,4-dimethylpyrrolidin-1-yl)phenyl]ethanol
CID 82971232
(1R)-1-[2-(4-methylpiperazin-1-yl)phenyl]ethanol
CID 78939148
(1S)-1-[2-(2,3,5-trimethylpiperidin-1-yl)phenyl]ethanol
CID 104939735
(1S)-1-[2-[3-(dimethylamino)pyrrolidin-1-yl]phenyl]ethanol
CID 63372106
(1R)-1-(2-morpholin-4-ylphenyl)ethanol
CID 78939110
(1R)-1-(2-thiomorpholin-4-ylphenyl)ethanol
CID 78939439
(1R)-1-[2-[3-(hydroxymethyl)pyrrolidin-1-yl]phenyl]ethanol
CID 103942831
1-[2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)phenyl]ethanol
CID 63170127
(1S)-1-[2-[3-(methoxymethyl)pyrrolidin-1-yl]phenyl]ethanol
CID 64597981
(1R)-1-[2-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)phenyl]ethanol
CID 78941146

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[2-(3,4-dimethylpyrrolidin-1-yl)phenyl]ethanol?
The IUPAC name of (1R)-1-[2-(3,4-dimethylpyrrolidin-1-yl)phenyl]ethanol (CID 79188358) is (1R)-1-[2-(3,4-dimethylpyrrolidin-1-yl)phenyl]ethanol.
What is the SMILES notation for (1R)-1-[2-(3,4-dimethylpyrrolidin-1-yl)phenyl]ethanol?
The canonical SMILES for (1R)-1-[2-(3,4-dimethylpyrrolidin-1-yl)phenyl]ethanol is CC1CN(c2ccccc2[C@@H](C)O)CC1C.
What is the InChIKey of (1R)-1-[2-(3,4-dimethylpyrrolidin-1-yl)phenyl]ethanol?
The InChIKey is ATDIFFSVWNBYDT-HTAVTVPLSA-N. The full InChI is InChI=1S/C14H21NO/c1-10-8-15(9-11(10)2)14-7-5-4-6-13(14)12(3)16/h4-7,10-12,16H,8-9H2,1-3H3/t10?,11?,12-/m1/s1.
What are the key properties of (1R)-1-[2-(3,4-dimethylpyrrolidin-1-yl)phenyl]ethanol?
(1R)-1-[2-(3,4-dimethylpyrrolidin-1-yl)phenyl]ethanol has a molecular weight of 219.33 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[2-(3,4-dimethylpyrrolidin-1-yl)phenyl]ethanol is sourced from PubChem (CID 79188358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).