(1-benzylpyrrolidin-3-yl)-diphenylmethanol

C24H25NO — CID 45073762

IUPAC(1-benzylpyrrolidin-3-yl)-diphenylmethanol
SMILESOC(c1ccccc1)(c1ccccc1)C1CCN(Cc2ccccc2)C1
InChIInChI=1S/C24H25NO/c26-24(21-12-6-2-7-13-21,22-14-8-3-9-15-22)23-16-17-25(19-23)18-20-10-4-1-5-11-20/h1-15,23,26H,16-19H2
InChIKeyQNOJLRIMRWPNKS-UHFFFAOYSA-N
MW343.47 g/mol
LogP4.44
Rot. Bonds5

About (1-benzylpyrrolidin-3-yl)-diphenylmethanol

(1-benzylpyrrolidin-3-yl)-diphenylmethanol (PubChem CID 45073762) has the molecular formula C24H25NO and a molecular weight of 343.47 g/mol. Its IUPAC name is (1-benzylpyrrolidin-3-yl)-diphenylmethanol.

Molecular Properties

Compound Name(1-benzylpyrrolidin-3-yl)-diphenylmethanol
PubChem CID45073762
Molecular FormulaC24H25NO
Molecular Weight343.47 g/mol
Exact Mass343.19
IUPAC Name(1-benzylpyrrolidin-3-yl)-diphenylmethanol
SMILESOC(c1ccccc1)(c1ccccc1)C1CCN(Cc2ccccc2)C1
InChIInChI=1S/C24H25NO/c26-24(21-12-6-2-7-13-21,22-14-8-3-9-15-22)23-16-17-25(19-23)18-20-10-4-1-5-11-20/h1-15,23,26H,16-19H2
InChIKeyQNOJLRIMRWPNKS-UHFFFAOYSA-N
XLogP4.44
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.47
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1-benzylpyrrolidin-3-yl)-diphenylmethanol?
The IUPAC name of (1-benzylpyrrolidin-3-yl)-diphenylmethanol (CID 45073762) is (1-benzylpyrrolidin-3-yl)-diphenylmethanol.
What is the SMILES notation for (1-benzylpyrrolidin-3-yl)-diphenylmethanol?
The canonical SMILES for (1-benzylpyrrolidin-3-yl)-diphenylmethanol is OC(c1ccccc1)(c1ccccc1)C1CCN(Cc2ccccc2)C1.
What is the InChIKey of (1-benzylpyrrolidin-3-yl)-diphenylmethanol?
The InChIKey is QNOJLRIMRWPNKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO/c26-24(21-12-6-2-7-13-21,22-14-8-3-9-15-22)23-16-17-25(19-23)18-20-10-4-1-5-11-20/h1-15,23,26H,16-19H2.
What are the key properties of (1-benzylpyrrolidin-3-yl)-diphenylmethanol?
(1-benzylpyrrolidin-3-yl)-diphenylmethanol has a molecular weight of 343.47 g/mol, XLogP of 4.44, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-benzylpyrrolidin-3-yl)-diphenylmethanol is sourced from PubChem (CID 45073762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).