(6R)-1,6-dibenzyl-N-methoxy-3,6-dihydro-2H-pyridin-4-amine

C20H24N2O — CID 57261366

IUPAC(6R)-1,6-dibenzyl-N-methoxy-3,6-dihydro-2H-pyridin-4-amine
SMILESCONC1=C[C@@H](Cc2ccccc2)N(Cc2ccccc2)CC1
InChIInChI=1S/C20H24N2O/c1-23-21-19-12-13-22(16-18-10-6-3-7-11-18)20(15-19)14-17-8-4-2-5-9-17/h2-11,15,20-21H,12-14,16H2,1H3/t20-/m1/s1
InChIKeyYQWKUNGALVSGEK-HXUWFJFHSA-N
MW308.43 g/mol
LogP3.54
Rot. Bonds6

About (6R)-1,6-dibenzyl-N-methoxy-3,6-dihydro-2H-pyridin-4-amine

(6R)-1,6-dibenzyl-N-methoxy-3,6-dihydro-2H-pyridin-4-amine (PubChem CID 57261366) has the molecular formula C20H24N2O and a molecular weight of 308.43 g/mol. Its IUPAC name is (6R)-1,6-dibenzyl-N-methoxy-3,6-dihydro-2H-pyridin-4-amine.

Molecular Properties

Compound Name(6R)-1,6-dibenzyl-N-methoxy-3,6-dihydro-2H-pyridin-4-amine
PubChem CID57261366
Molecular FormulaC20H24N2O
Molecular Weight308.43 g/mol
Exact Mass308.19
IUPAC Name(6R)-1,6-dibenzyl-N-methoxy-3,6-dihydro-2H-pyridin-4-amine
SMILESCONC1=C[C@@H](Cc2ccccc2)N(Cc2ccccc2)CC1
InChIInChI=1S/C20H24N2O/c1-23-21-19-12-13-22(16-18-10-6-3-7-11-18)20(15-19)14-17-8-4-2-5-9-17/h2-11,15,20-21H,12-14,16H2,1H3/t20-/m1/s1
InChIKeyYQWKUNGALVSGEK-HXUWFJFHSA-N
XLogP3.54
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (6R)-1,6-dibenzyl-N-methoxy-3,6-dihydro-2H-pyridin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (6R)-1,6-dibenzyl-N-methoxy-3,6-dihydro-2H-pyridin-4-amine?
The IUPAC name of (6R)-1,6-dibenzyl-N-methoxy-3,6-dihydro-2H-pyridin-4-amine (CID 57261366) is (6R)-1,6-dibenzyl-N-methoxy-3,6-dihydro-2H-pyridin-4-amine.
What is the SMILES notation for (6R)-1,6-dibenzyl-N-methoxy-3,6-dihydro-2H-pyridin-4-amine?
The canonical SMILES for (6R)-1,6-dibenzyl-N-methoxy-3,6-dihydro-2H-pyridin-4-amine is CONC1=C[C@@H](Cc2ccccc2)N(Cc2ccccc2)CC1.
What is the InChIKey of (6R)-1,6-dibenzyl-N-methoxy-3,6-dihydro-2H-pyridin-4-amine?
The InChIKey is YQWKUNGALVSGEK-HXUWFJFHSA-N. The full InChI is InChI=1S/C20H24N2O/c1-23-21-19-12-13-22(16-18-10-6-3-7-11-18)20(15-19)14-17-8-4-2-5-9-17/h2-11,15,20-21H,12-14,16H2,1H3/t20-/m1/s1.
What are the key properties of (6R)-1,6-dibenzyl-N-methoxy-3,6-dihydro-2H-pyridin-4-amine?
(6R)-1,6-dibenzyl-N-methoxy-3,6-dihydro-2H-pyridin-4-amine has a molecular weight of 308.43 g/mol, XLogP of 3.54, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-1,6-dibenzyl-N-methoxy-3,6-dihydro-2H-pyridin-4-amine is sourced from PubChem (CID 57261366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).