N-[(1S)-1-naphthalen-2-ylethyl]-1-pyridin-2-ylmethanimine

C18H16N2 — CID 100979851

IUPACN-[(1S)-1-naphthalen-2-ylethyl]-1-pyridin-2-ylmethanimine
SMILESC[C@H](/N=C/c1ccccn1)c1ccc2ccccc2c1
InChIInChI=1S/C18H16N2/c1-14(20-13-18-8-4-5-11-19-18)16-10-9-15-6-2-3-7-17(15)12-16/h2-14H,1H3/b20-13+/t14-/m0/s1
InChIKeyZBUAGOXFBCUWHC-ZXOFLVKFSA-N
MW260.34 g/mol
LogP4.41
Rot. Bonds3

About N-[(1S)-1-naphthalen-2-ylethyl]-1-pyridin-2-ylmethanimine

N-[(1S)-1-naphthalen-2-ylethyl]-1-pyridin-2-ylmethanimine (PubChem CID 100979851) has the molecular formula C18H16N2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-[(1S)-1-naphthalen-2-ylethyl]-1-pyridin-2-ylmethanimine.

Molecular Properties

Compound NameN-[(1S)-1-naphthalen-2-ylethyl]-1-pyridin-2-ylmethanimine
PubChem CID100979851
Molecular FormulaC18H16N2
Molecular Weight260.34 g/mol
Exact Mass260.13
IUPAC NameN-[(1S)-1-naphthalen-2-ylethyl]-1-pyridin-2-ylmethanimine
SMILESC[C@H](/N=C/c1ccccn1)c1ccc2ccccc2c1
InChIInChI=1S/C18H16N2/c1-14(20-13-18-8-4-5-11-19-18)16-10-9-15-6-2-3-7-17(15)12-16/h2-14H,1H3/b20-13+/t14-/m0/s1
InChIKeyZBUAGOXFBCUWHC-ZXOFLVKFSA-N
XLogP4.41
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-naphthalen-2-yl-N-[(E)-pyridin-2-ylmethylideneamino]naphthalen-2-amine
CID 71606172
N-[(1R)-1-cyclopenta-1,3-dien-1-ylethyl]-1-pyridin-2-ylmethanimine
CID 101469061
5-(hydroxymethyl)-2-methyl-4-[[(1S)-1-naphthalen-2-ylethyl]iminomethyl]pyridin-3-ol
CID 135828831
CID 16688127
CID 16688127
N-[(1R)-1-cyclohexylethyl]-1-pyridin-2-ylmethanimine
CID 100979849
ethane;2-propan-2-ylnaphthalene
CID 142226111
[(1S)-1-naphthalen-2-ylethyl]azanium chloride
CID 155931519
N-[4-[[3,5-di(propan-2-yl)-4-(pyridin-2-ylmethylideneamino)phenyl]methyl]-2,6-di(propan-2-yl)phenyl]-1-pyridin-2-ylmethanimine
CID 68745734
2-(4-naphthalen-2-ylbuta-1,3-dienyl)pyridine
CID 90870778
tetrakis(N-[2,6-di(propan-2-yl)phenyl]-1-pyridin-2-ylmethanimine);zinc
CID 139116950
2-propan-2-ylpentacene
CID 153380535
N-tert-butyl-1-pyridin-2-ylmethanimine
CID 11389570

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-naphthalen-2-ylethyl]-1-pyridin-2-ylmethanimine?
The IUPAC name of N-[(1S)-1-naphthalen-2-ylethyl]-1-pyridin-2-ylmethanimine (CID 100979851) is N-[(1S)-1-naphthalen-2-ylethyl]-1-pyridin-2-ylmethanimine.
What is the SMILES notation for N-[(1S)-1-naphthalen-2-ylethyl]-1-pyridin-2-ylmethanimine?
The canonical SMILES for N-[(1S)-1-naphthalen-2-ylethyl]-1-pyridin-2-ylmethanimine is C[C@H](/N=C/c1ccccn1)c1ccc2ccccc2c1.
What is the InChIKey of N-[(1S)-1-naphthalen-2-ylethyl]-1-pyridin-2-ylmethanimine?
The InChIKey is ZBUAGOXFBCUWHC-ZXOFLVKFSA-N. The full InChI is InChI=1S/C18H16N2/c1-14(20-13-18-8-4-5-11-19-18)16-10-9-15-6-2-3-7-17(15)12-16/h2-14H,1H3/b20-13+/t14-/m0/s1.
What are the key properties of N-[(1S)-1-naphthalen-2-ylethyl]-1-pyridin-2-ylmethanimine?
N-[(1S)-1-naphthalen-2-ylethyl]-1-pyridin-2-ylmethanimine has a molecular weight of 260.34 g/mol, XLogP of 4.41, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-naphthalen-2-ylethyl]-1-pyridin-2-ylmethanimine is sourced from PubChem (CID 100979851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).