2-[3-(dimethylamino)-1-phenyl-1-pyridin-2-ylpropan-2-yl]oxy-N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine

C32H38N4O — CID 68666892

IUPAC2-[3-(dimethylamino)-1-phenyl-1-pyridin-2-ylpropan-2-yl]oxy-N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine
SMILESCN(C)CC(OC(CN(C)C)C(c1ccccc1)c1ccccn1)C(c1ccccc1)c1ccccn1
InChIInChI=1S/C32H38N4O/c1-35(2)23-29(31(25-15-7-5-8-16-25)27-19-11-13-21-33-27)37-30(24-36(3)4)32(26-17-9-6-10-18-26)28-20-12-14-22-34-28/h5-22,29-32H,23-24H2,1-4H3
InChIKeyMOXZPDPGMJDLQQ-UHFFFAOYSA-N
MW494.68 g/mol
LogP5.32
Rot. Bonds12

About 2-[3-(dimethylamino)-1-phenyl-1-pyridin-2-ylpropan-2-yl]oxy-N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine

2-[3-(dimethylamino)-1-phenyl-1-pyridin-2-ylpropan-2-yl]oxy-N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine (PubChem CID 68666892) has the molecular formula C32H38N4O and a molecular weight of 494.68 g/mol. Its IUPAC name is 2-[3-(dimethylamino)-1-phenyl-1-pyridin-2-ylpropan-2-yl]oxy-N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine.

Molecular Properties

Compound Name2-[3-(dimethylamino)-1-phenyl-1-pyridin-2-ylpropan-2-yl]oxy-N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine
PubChem CID68666892
Molecular FormulaC32H38N4O
Molecular Weight494.68 g/mol
Exact Mass494.30
IUPAC Name2-[3-(dimethylamino)-1-phenyl-1-pyridin-2-ylpropan-2-yl]oxy-N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine
SMILESCN(C)CC(OC(CN(C)C)C(c1ccccc1)c1ccccn1)C(c1ccccc1)c1ccccn1
InChIInChI=1S/C32H38N4O/c1-35(2)23-29(31(25-15-7-5-8-16-25)27-19-11-13-21-33-27)37-30(24-36(3)4)32(26-17-9-6-10-18-26)28-20-12-14-22-34-28/h5-22,29-32H,23-24H2,1-4H3
InChIKeyMOXZPDPGMJDLQQ-UHFFFAOYSA-N
XLogP5.32
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500494.68
LogP ≤ 55.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N,N-dimethyl-2-phenyl-2-pyridin-2-ylethanamine;hydrochloride
CID 54610221
(3R)-N-methoxy-N-methyl-3-phenyl-3-pyridin-2-ylpropan-1-amine
CID 125488138
2-[(1R,2R)-1,2-bis(4-ethylphenyl)-2-pyridin-2-ylethyl]pyridine
CID 134852972
(3R)-3-(4-bromophenyl)-N,N-dimethyl-3-pyridin-2-ylpropan-1-amine
CID 6328079
N-methyl-1-phenyl-1-pyridin-2-yl-N-(pyridin-4-ylmethyl)methanamine
CID 84591336
2-[phenyl(pyridin-2-yl)methyl]pyridine
CID 4110137
[(1S,2S)-1-phenyl-2-phosphanyl-2-pyridin-2-ylethyl]phosphane
CID 101016472
ethane;2-(1-phenylethyl)pyridine
CID 143899083
4-(4-chlorophenyl)-N,N-dimethyl-4-pyridin-2-ylbutan-1-amine
CID 90681228
1-phenyl-2,2-dipyridin-2-yl-N,N-bis(pyridin-2-ylmethyl)ethanamine
CID 70142238
dimethyl-[(3R)-3-phenyl-3-pyridin-2-ylpropyl]azanium
CID 6954515
2-[(1S)-2-(4,5-dihydro-1H-imidazol-2-yl)-1-phenylethyl]pyridine
CID 12632116

Frequently Asked Questions

What is the IUPAC name of 2-[3-(dimethylamino)-1-phenyl-1-pyridin-2-ylpropan-2-yl]oxy-N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine?
The IUPAC name of 2-[3-(dimethylamino)-1-phenyl-1-pyridin-2-ylpropan-2-yl]oxy-N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine (CID 68666892) is 2-[3-(dimethylamino)-1-phenyl-1-pyridin-2-ylpropan-2-yl]oxy-N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine.
What is the SMILES notation for 2-[3-(dimethylamino)-1-phenyl-1-pyridin-2-ylpropan-2-yl]oxy-N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine?
The canonical SMILES for 2-[3-(dimethylamino)-1-phenyl-1-pyridin-2-ylpropan-2-yl]oxy-N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine is CN(C)CC(OC(CN(C)C)C(c1ccccc1)c1ccccn1)C(c1ccccc1)c1ccccn1.
What is the InChIKey of 2-[3-(dimethylamino)-1-phenyl-1-pyridin-2-ylpropan-2-yl]oxy-N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine?
The InChIKey is MOXZPDPGMJDLQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H38N4O/c1-35(2)23-29(31(25-15-7-5-8-16-25)27-19-11-13-21-33-27)37-30(24-36(3)4)32(26-17-9-6-10-18-26)28-20-12-14-22-34-28/h5-22,29-32H,23-24H2,1-4H3.
What are the key properties of 2-[3-(dimethylamino)-1-phenyl-1-pyridin-2-ylpropan-2-yl]oxy-N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine?
2-[3-(dimethylamino)-1-phenyl-1-pyridin-2-ylpropan-2-yl]oxy-N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine has a molecular weight of 494.68 g/mol, XLogP of 5.32, 12 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(dimethylamino)-1-phenyl-1-pyridin-2-ylpropan-2-yl]oxy-N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine is sourced from PubChem (CID 68666892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).