N-methyl-1-(5-methyl-2-pyridinyl)ethanimine

C9H12N2 — CID 123351090

IUPACN-methyl-1-(5-methyl-2-pyridinyl)ethanimine
SMILESC/N=C(\C)c1ccc(C)cn1
InChIInChI=1S/C9H12N2/c1-7-4-5-9(11-6-7)8(2)10-3/h4-6H,1-3H3/b10-8+
InChIKeyBKDPACQBORMSQU-CSKARUKUSA-N
MW148.21 g/mol
LogP1.83
Rot. Bonds1

About N-methyl-1-(5-methyl-2-pyridinyl)ethanimine

N-methyl-1-(5-methyl-2-pyridinyl)ethanimine (PubChem CID 123351090) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is N-methyl-1-(5-methyl-2-pyridinyl)ethanimine.

Molecular Properties

Compound NameN-methyl-1-(5-methyl-2-pyridinyl)ethanimine
PubChem CID123351090
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC NameN-methyl-1-(5-methyl-2-pyridinyl)ethanimine
SMILESC/N=C(\C)c1ccc(C)cn1
InChIInChI=1S/C9H12N2/c1-7-4-5-9(11-6-7)8(2)10-3/h4-6H,1-3H3/b10-8+
InChIKeyBKDPACQBORMSQU-CSKARUKUSA-N
XLogP1.83
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5-methyl-2-pyridinyl)ethanimine?
The IUPAC name of N-methyl-1-(5-methyl-2-pyridinyl)ethanimine (CID 123351090) is N-methyl-1-(5-methyl-2-pyridinyl)ethanimine.
What is the SMILES notation for N-methyl-1-(5-methyl-2-pyridinyl)ethanimine?
The canonical SMILES for N-methyl-1-(5-methyl-2-pyridinyl)ethanimine is C/N=C(\C)c1ccc(C)cn1.
What is the InChIKey of N-methyl-1-(5-methyl-2-pyridinyl)ethanimine?
The InChIKey is BKDPACQBORMSQU-CSKARUKUSA-N. The full InChI is InChI=1S/C9H12N2/c1-7-4-5-9(11-6-7)8(2)10-3/h4-6H,1-3H3/b10-8+.
What are the key properties of N-methyl-1-(5-methyl-2-pyridinyl)ethanimine?
N-methyl-1-(5-methyl-2-pyridinyl)ethanimine has a molecular weight of 148.21 g/mol, XLogP of 1.83, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5-methyl-2-pyridinyl)ethanimine is sourced from PubChem (CID 123351090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).