(2S)-2-methyl-2-naphthalen-2-yl-3-pyridin-3-ylpropan-1-amine

C19H20N2 — CID 118675585

IUPAC(2S)-2-methyl-2-naphthalen-2-yl-3-pyridin-3-ylpropan-1-amine
SMILESC[C@](CN)(Cc1cccnc1)c1ccc2ccccc2c1
InChIInChI=1S/C19H20N2/c1-19(14-20,12-15-5-4-10-21-13-15)18-9-8-16-6-2-3-7-17(16)11-18/h2-11,13H,12,14,20H2,1H3/t19-/m1/s1
InChIKeyZZLLQFDJKBAKCE-LJQANCHMSA-N
MW276.38 g/mol
LogP3.69
Rot. Bonds4

About (2S)-2-methyl-2-naphthalen-2-yl-3-pyridin-3-ylpropan-1-amine

(2S)-2-methyl-2-naphthalen-2-yl-3-pyridin-3-ylpropan-1-amine (PubChem CID 118675585) has the molecular formula C19H20N2 and a molecular weight of 276.38 g/mol. Its IUPAC name is (2S)-2-methyl-2-naphthalen-2-yl-3-pyridin-3-ylpropan-1-amine.

Molecular Properties

Compound Name(2S)-2-methyl-2-naphthalen-2-yl-3-pyridin-3-ylpropan-1-amine
PubChem CID118675585
Molecular FormulaC19H20N2
Molecular Weight276.38 g/mol
Exact Mass276.16
IUPAC Name(2S)-2-methyl-2-naphthalen-2-yl-3-pyridin-3-ylpropan-1-amine
SMILESC[C@](CN)(Cc1cccnc1)c1ccc2ccccc2c1
InChIInChI=1S/C19H20N2/c1-19(14-20,12-15-5-4-10-21-13-15)18-9-8-16-6-2-3-7-17(16)11-18/h2-11,13H,12,14,20H2,1H3/t19-/m1/s1
InChIKeyZZLLQFDJKBAKCE-LJQANCHMSA-N
XLogP3.69
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-methyl-2-naphthalen-2-yl-3-pyridin-3-ylpropan-1-amine?
The IUPAC name of (2S)-2-methyl-2-naphthalen-2-yl-3-pyridin-3-ylpropan-1-amine (CID 118675585) is (2S)-2-methyl-2-naphthalen-2-yl-3-pyridin-3-ylpropan-1-amine.
What is the SMILES notation for (2S)-2-methyl-2-naphthalen-2-yl-3-pyridin-3-ylpropan-1-amine?
The canonical SMILES for (2S)-2-methyl-2-naphthalen-2-yl-3-pyridin-3-ylpropan-1-amine is C[C@](CN)(Cc1cccnc1)c1ccc2ccccc2c1.
What is the InChIKey of (2S)-2-methyl-2-naphthalen-2-yl-3-pyridin-3-ylpropan-1-amine?
The InChIKey is ZZLLQFDJKBAKCE-LJQANCHMSA-N. The full InChI is InChI=1S/C19H20N2/c1-19(14-20,12-15-5-4-10-21-13-15)18-9-8-16-6-2-3-7-17(16)11-18/h2-11,13H,12,14,20H2,1H3/t19-/m1/s1.
What are the key properties of (2S)-2-methyl-2-naphthalen-2-yl-3-pyridin-3-ylpropan-1-amine?
(2S)-2-methyl-2-naphthalen-2-yl-3-pyridin-3-ylpropan-1-amine has a molecular weight of 276.38 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-methyl-2-naphthalen-2-yl-3-pyridin-3-ylpropan-1-amine is sourced from PubChem (CID 118675585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).