1-(6-methyl-2-pyridinyl)-N-[(1S)-1-(6-methyl-2-pyridinyl)ethyl]ethanimine

C16H19N3 — CID 59444627

IUPAC1-(6-methyl-2-pyridinyl)-N-[(1S)-1-(6-methyl-2-pyridinyl)ethyl]ethanimine
SMILESC/C(=N\[C@@H](C)c1cccc(C)n1)c1cccc(C)n1
InChIInChI=1S/C16H19N3/c1-11-7-5-9-15(17-11)13(3)19-14(4)16-10-6-8-12(2)18-16/h5-10,13H,1-4H3/b19-14+/t13-/m0/s1
InChIKeyWPASCTPYPPKPAC-AZDDOORDSA-N
MW253.35 g/mol
LogP3.66
Rot. Bonds3

About 1-(6-methyl-2-pyridinyl)-N-[(1S)-1-(6-methyl-2-pyridinyl)ethyl]ethanimine

1-(6-methyl-2-pyridinyl)-N-[(1S)-1-(6-methyl-2-pyridinyl)ethyl]ethanimine (PubChem CID 59444627) has the molecular formula C16H19N3 and a molecular weight of 253.35 g/mol. Its IUPAC name is 1-(6-methyl-2-pyridinyl)-N-[(1S)-1-(6-methyl-2-pyridinyl)ethyl]ethanimine.

Molecular Properties

Compound Name1-(6-methyl-2-pyridinyl)-N-[(1S)-1-(6-methyl-2-pyridinyl)ethyl]ethanimine
PubChem CID59444627
Molecular FormulaC16H19N3
Molecular Weight253.35 g/mol
Exact Mass253.16
IUPAC Name1-(6-methyl-2-pyridinyl)-N-[(1S)-1-(6-methyl-2-pyridinyl)ethyl]ethanimine
SMILESC/C(=N\[C@@H](C)c1cccc(C)n1)c1cccc(C)n1
InChIInChI=1S/C16H19N3/c1-11-7-5-9-15(17-11)13(3)19-14(4)16-10-6-8-12(2)18-16/h5-10,13H,1-4H3/b19-14+/t13-/m0/s1
InChIKeyWPASCTPYPPKPAC-AZDDOORDSA-N
XLogP3.66
TPSA38.14 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-(6-methyl-2-pyridinyl)-N-[(1S)-1-(6-methyl-2-pyridinyl)ethyl]ethanimine 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 1-(6-methyl-2-pyridinyl)-N-[(1S)-1-(6-methyl-2-pyridinyl)ethyl]ethanimine?
The IUPAC name of 1-(6-methyl-2-pyridinyl)-N-[(1S)-1-(6-methyl-2-pyridinyl)ethyl]ethanimine (CID 59444627) is 1-(6-methyl-2-pyridinyl)-N-[(1S)-1-(6-methyl-2-pyridinyl)ethyl]ethanimine.
What is the SMILES notation for 1-(6-methyl-2-pyridinyl)-N-[(1S)-1-(6-methyl-2-pyridinyl)ethyl]ethanimine?
The canonical SMILES for 1-(6-methyl-2-pyridinyl)-N-[(1S)-1-(6-methyl-2-pyridinyl)ethyl]ethanimine is C/C(=N\[C@@H](C)c1cccc(C)n1)c1cccc(C)n1.
What is the InChIKey of 1-(6-methyl-2-pyridinyl)-N-[(1S)-1-(6-methyl-2-pyridinyl)ethyl]ethanimine?
The InChIKey is WPASCTPYPPKPAC-AZDDOORDSA-N. The full InChI is InChI=1S/C16H19N3/c1-11-7-5-9-15(17-11)13(3)19-14(4)16-10-6-8-12(2)18-16/h5-10,13H,1-4H3/b19-14+/t13-/m0/s1.
What are the key properties of 1-(6-methyl-2-pyridinyl)-N-[(1S)-1-(6-methyl-2-pyridinyl)ethyl]ethanimine?
1-(6-methyl-2-pyridinyl)-N-[(1S)-1-(6-methyl-2-pyridinyl)ethyl]ethanimine has a molecular weight of 253.35 g/mol, XLogP of 3.66, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methyl-2-pyridinyl)-N-[(1S)-1-(6-methyl-2-pyridinyl)ethyl]ethanimine is sourced from PubChem (CID 59444627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).