dinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol

C25H23NO — CID 2733810

IUPACdinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol
SMILESOC(c1ccc2ccccc2c1)(c1ccc2ccccc2c1)[C@@H]1CCCN1
InChIInChI=1S/C25H23NO/c27-25(24-10-5-15-26-24,22-13-11-18-6-1-3-8-20(18)16-22)23-14-12-19-7-2-4-9-21(19)17-23/h1-4,6-9,11-14,16-17,24,26-27H,5,10,15H2/t24-/m0/s1
InChIKeyLNUDNNFEXRHHGY-DEOSSOPVSA-N
MW353.47 g/mol
LogP4.98
Rot. Bonds3

About dinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol

dinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol (PubChem CID 2733810) has the molecular formula C25H23NO and a molecular weight of 353.47 g/mol. Its IUPAC name is dinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Namedinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol
PubChem CID2733810
Molecular FormulaC25H23NO
Molecular Weight353.47 g/mol
Exact Mass353.18
IUPAC Namedinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol
SMILESOC(c1ccc2ccccc2c1)(c1ccc2ccccc2c1)[C@@H]1CCCN1
InChIInChI=1S/C25H23NO/c27-25(24-10-5-15-26-24,22-13-11-18-6-1-3-8-20(18)16-22)23-14-12-19-7-2-4-9-21(19)17-23/h1-4,6-9,11-14,16-17,24,26-27H,5,10,15H2/t24-/m0/s1
InChIKeyLNUDNNFEXRHHGY-DEOSSOPVSA-N
XLogP4.98
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.47
LogP ≤ 54.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze dinaphthalen-2-yl-[(2S)-pyrrolidin-2-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

Related Compounds

Pronethalol
CID 4930
(1S,2S)-3-(Methylamino)-2-naphthalen-2-yl-1-phenylpropan-1-ol
CID 20631904
Pronetalol hydrochloride
CID 60975
Diphenylprolinol
CID 204386
2-Pyrrolidinemethanol, alpha,alpha-diphenyl-, (S)-
CID 2724899
Butidrine
CID 15177
Pronetalol, (R)-
CID 6604181
(1R,2R)-3-(methylamino)-2-(naphthalen-2-yl)-1-phenylpropan-1-ol
CID 20631901
2-Pyrrolidinemethanol, alpha,alpha-diphenyl-, hydrochloride
CID 204385
(R)-Di-2-naphthylprolinol
CID 7020307
1-Benzyl-3-(2-naphthyl)-3-pyrrolidinol hydrochloride
CID 2894287
[2-[3-(Methylamino)-2-naphthalen-2-ylpropyl]phenyl]methanol
CID 86288291

Frequently Asked Questions

What is the IUPAC name of dinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol?
The IUPAC name of dinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol (CID 2733810) is dinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol.
What is the SMILES notation for dinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol?
The canonical SMILES for dinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol is OC(c1ccc2ccccc2c1)(c1ccc2ccccc2c1)[C@@H]1CCCN1.
What is the InChIKey of dinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol?
The InChIKey is LNUDNNFEXRHHGY-DEOSSOPVSA-N. The full InChI is InChI=1S/C25H23NO/c27-25(24-10-5-15-26-24,22-13-11-18-6-1-3-8-20(18)16-22)23-14-12-19-7-2-4-9-21(19)17-23/h1-4,6-9,11-14,16-17,24,26-27H,5,10,15H2/t24-/m0/s1.
What are the key properties of dinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol?
dinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol has a molecular weight of 353.47 g/mol, XLogP of 4.98, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol is sourced from PubChem (CID 2733810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).