(1R)-1-[4-(3-phenylpyrrolidin-1-yl)phenyl]ethanol

C18H21NO — CID 78940951

IUPAC(1R)-1-[4-(3-phenylpyrrolidin-1-yl)phenyl]ethanol
SMILESC[C@@H](O)c1ccc(N2CCC(c3ccccc3)C2)cc1
InChIInChI=1S/C18H21NO/c1-14(20)15-7-9-18(10-8-15)19-12-11-17(13-19)16-5-3-2-4-6-16/h2-10,14,17,20H,11-13H2,1H3/t14-,17?/m1/s1
InChIKeyPGAZRDSRRVVUEP-XPCCGILXSA-N
MW267.37 g/mol
LogP3.73
Rot. Bonds3

About (1R)-1-[4-(3-phenylpyrrolidin-1-yl)phenyl]ethanol

(1R)-1-[4-(3-phenylpyrrolidin-1-yl)phenyl]ethanol (PubChem CID 78940951) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is (1R)-1-[4-(3-phenylpyrrolidin-1-yl)phenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[4-(3-phenylpyrrolidin-1-yl)phenyl]ethanol
PubChem CID78940951
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC Name(1R)-1-[4-(3-phenylpyrrolidin-1-yl)phenyl]ethanol
SMILESC[C@@H](O)c1ccc(N2CCC(c3ccccc3)C2)cc1
InChIInChI=1S/C18H21NO/c1-14(20)15-7-9-18(10-8-15)19-12-11-17(13-19)16-5-3-2-4-6-16/h2-10,14,17,20H,11-13H2,1H3/t14-,17?/m1/s1
InChIKeyPGAZRDSRRVVUEP-XPCCGILXSA-N
XLogP3.73
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}, {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

Analyze (1R)-1-[4-(3-phenylpyrrolidin-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

C.I. 42555:1
CID 68050
4,4'-Bis(dimethylamino)benzhydrol
CID 92742
Malachite Green carbinol
CID 10521
4-Dimethylaminobenzyl alcohol
CID 137166
Benzenemethanol, 4-(dimethylamino)-alpha,alpha-diphenyl-
CID 614765
2-Diethylamino-9-fluorenol
CID 224125
2-(4-(Benzyl(ethyl)amino)phenyl)-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 11574384
2-(4-(Benzyl(2,2,2-trifluoroethyl)amino)phenyl)-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 11582802
2-(4-(Ethyl(phenethyl)amino)phenyl)-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 11639715
2-(4-(Ethyl(2-hydroxy-2-phenylethyl)amino)phenyl)-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 11661439
1,1,1,3,3,3-Hexafluoro-2-{4-[methyl(phenylmethyl)amino]phenyl}-2-propanol
CID 16049406
1-p-Aminophenyl-2-(4-benzyl-piperidin-1-yl)-propan-1-ol
CID 22449936

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[4-(3-phenylpyrrolidin-1-yl)phenyl]ethanol?
The IUPAC name of (1R)-1-[4-(3-phenylpyrrolidin-1-yl)phenyl]ethanol (CID 78940951) is (1R)-1-[4-(3-phenylpyrrolidin-1-yl)phenyl]ethanol.
What is the SMILES notation for (1R)-1-[4-(3-phenylpyrrolidin-1-yl)phenyl]ethanol?
The canonical SMILES for (1R)-1-[4-(3-phenylpyrrolidin-1-yl)phenyl]ethanol is C[C@@H](O)c1ccc(N2CCC(c3ccccc3)C2)cc1.
What is the InChIKey of (1R)-1-[4-(3-phenylpyrrolidin-1-yl)phenyl]ethanol?
The InChIKey is PGAZRDSRRVVUEP-XPCCGILXSA-N. The full InChI is InChI=1S/C18H21NO/c1-14(20)15-7-9-18(10-8-15)19-12-11-17(13-19)16-5-3-2-4-6-16/h2-10,14,17,20H,11-13H2,1H3/t14-,17?/m1/s1.
What are the key properties of (1R)-1-[4-(3-phenylpyrrolidin-1-yl)phenyl]ethanol?
(1R)-1-[4-(3-phenylpyrrolidin-1-yl)phenyl]ethanol has a molecular weight of 267.37 g/mol, XLogP of 3.73, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[4-(3-phenylpyrrolidin-1-yl)phenyl]ethanol is sourced from PubChem (CID 78940951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).