1-[2-hydroxy-3-(2-phenylphenyl)propyl]pyrrolidine-3,4-diol

C19H23NO3 — CID 21396209

IUPAC1-[2-hydroxy-3-(2-phenylphenyl)propyl]pyrrolidine-3,4-diol
SMILESOC(Cc1ccccc1-c1ccccc1)CN1CC(O)C(O)C1
InChIInChI=1S/C19H23NO3/c21-16(11-20-12-18(22)19(23)13-20)10-15-8-4-5-9-17(15)14-6-2-1-3-7-14/h1-9,16,18-19,21-23H,10-13H2
InChIKeyOZAYZTMJZYEYNL-UHFFFAOYSA-N
MW313.40 g/mol
LogP1.29
Rot. Bonds5

About 1-[2-hydroxy-3-(2-phenylphenyl)propyl]pyrrolidine-3,4-diol

1-[2-hydroxy-3-(2-phenylphenyl)propyl]pyrrolidine-3,4-diol (PubChem CID 21396209) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is 1-[2-hydroxy-3-(2-phenylphenyl)propyl]pyrrolidine-3,4-diol.

Molecular Properties

Compound Name1-[2-hydroxy-3-(2-phenylphenyl)propyl]pyrrolidine-3,4-diol
PubChem CID21396209
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC Name1-[2-hydroxy-3-(2-phenylphenyl)propyl]pyrrolidine-3,4-diol
SMILESOC(Cc1ccccc1-c1ccccc1)CN1CC(O)C(O)C1
InChIInChI=1S/C19H23NO3/c21-16(11-20-12-18(22)19(23)13-20)10-15-8-4-5-9-17(15)14-6-2-1-3-7-14/h1-9,16,18-19,21-23H,10-13H2
InChIKeyOZAYZTMJZYEYNL-UHFFFAOYSA-N
XLogP1.29
TPSA63.93 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 51.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-hydroxy-3-(2-phenylphenyl)propyl]pyrrolidine-3,4-diol?
The IUPAC name of 1-[2-hydroxy-3-(2-phenylphenyl)propyl]pyrrolidine-3,4-diol (CID 21396209) is 1-[2-hydroxy-3-(2-phenylphenyl)propyl]pyrrolidine-3,4-diol.
What is the SMILES notation for 1-[2-hydroxy-3-(2-phenylphenyl)propyl]pyrrolidine-3,4-diol?
The canonical SMILES for 1-[2-hydroxy-3-(2-phenylphenyl)propyl]pyrrolidine-3,4-diol is OC(Cc1ccccc1-c1ccccc1)CN1CC(O)C(O)C1.
What is the InChIKey of 1-[2-hydroxy-3-(2-phenylphenyl)propyl]pyrrolidine-3,4-diol?
The InChIKey is OZAYZTMJZYEYNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c21-16(11-20-12-18(22)19(23)13-20)10-15-8-4-5-9-17(15)14-6-2-1-3-7-14/h1-9,16,18-19,21-23H,10-13H2.
What are the key properties of 1-[2-hydroxy-3-(2-phenylphenyl)propyl]pyrrolidine-3,4-diol?
1-[2-hydroxy-3-(2-phenylphenyl)propyl]pyrrolidine-3,4-diol has a molecular weight of 313.40 g/mol, XLogP of 1.29, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-hydroxy-3-(2-phenylphenyl)propyl]pyrrolidine-3,4-diol is sourced from PubChem (CID 21396209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).