N,N-dibenzyl-1-[(2R)-oxolan-2-yl]methanamine

C19H23NO — CID 155675176

IUPACN,N-dibenzyl-1-[(2R)-oxolan-2-yl]methanamine
SMILESc1ccc(CN(Cc2ccccc2)C[C@H]2CCCO2)cc1
InChIInChI=1S/C19H23NO/c1-3-8-17(9-4-1)14-20(16-19-12-7-13-21-19)15-18-10-5-2-6-11-18/h1-6,8-11,19H,7,12-16H2/t19-/m1/s1
InChIKeyOQGFINUFOVVGLS-LJQANCHMSA-N
MW281.40 g/mol
LogP3.87
Rot. Bonds6

About N,N-dibenzyl-1-[(2R)-oxolan-2-yl]methanamine

N,N-dibenzyl-1-[(2R)-oxolan-2-yl]methanamine (PubChem CID 155675176) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is N,N-dibenzyl-1-[(2R)-oxolan-2-yl]methanamine.

Molecular Properties

Compound NameN,N-dibenzyl-1-[(2R)-oxolan-2-yl]methanamine
PubChem CID155675176
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC NameN,N-dibenzyl-1-[(2R)-oxolan-2-yl]methanamine
SMILESc1ccc(CN(Cc2ccccc2)C[C@H]2CCCO2)cc1
InChIInChI=1S/C19H23NO/c1-3-8-17(9-4-1)14-20(16-19-12-7-13-21-19)15-18-10-5-2-6-11-18/h1-6,8-11,19H,7,12-16H2/t19-/m1/s1
InChIKeyOQGFINUFOVVGLS-LJQANCHMSA-N
XLogP3.87
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dibenzyl-1-[(2R)-oxolan-2-yl]methanamine?
The IUPAC name of N,N-dibenzyl-1-[(2R)-oxolan-2-yl]methanamine (CID 155675176) is N,N-dibenzyl-1-[(2R)-oxolan-2-yl]methanamine.
What is the SMILES notation for N,N-dibenzyl-1-[(2R)-oxolan-2-yl]methanamine?
The canonical SMILES for N,N-dibenzyl-1-[(2R)-oxolan-2-yl]methanamine is c1ccc(CN(Cc2ccccc2)C[C@H]2CCCO2)cc1.
What is the InChIKey of N,N-dibenzyl-1-[(2R)-oxolan-2-yl]methanamine?
The InChIKey is OQGFINUFOVVGLS-LJQANCHMSA-N. The full InChI is InChI=1S/C19H23NO/c1-3-8-17(9-4-1)14-20(16-19-12-7-13-21-19)15-18-10-5-2-6-11-18/h1-6,8-11,19H,7,12-16H2/t19-/m1/s1.
What are the key properties of N,N-dibenzyl-1-[(2R)-oxolan-2-yl]methanamine?
N,N-dibenzyl-1-[(2R)-oxolan-2-yl]methanamine has a molecular weight of 281.40 g/mol, XLogP of 3.87, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibenzyl-1-[(2R)-oxolan-2-yl]methanamine is sourced from PubChem (CID 155675176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).