2-imino-N-methyl-2-(4-methylphenyl)ethanamine

C10H14N2 — CID 142977852

IUPAC2-imino-N-methyl-2-(4-methylphenyl)ethanamine
SMILES[H]/N=C(\CNC)c1ccc(C)cc1
InChIInChI=1S/C10H14N2/c1-8-3-5-9(6-4-8)10(11)7-12-2/h3-6,11-12H,7H2,1-2H3/b11-10+
InChIKeyUAUJELFAWDJTGM-ZHACJKMWSA-N
MW162.24 g/mol
LogP1.58
Rot. Bonds3

About 2-imino-N-methyl-2-(4-methylphenyl)ethanamine

2-imino-N-methyl-2-(4-methylphenyl)ethanamine (PubChem CID 142977852) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is 2-imino-N-methyl-2-(4-methylphenyl)ethanamine.

Molecular Properties

Compound Name2-imino-N-methyl-2-(4-methylphenyl)ethanamine
PubChem CID142977852
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Name2-imino-N-methyl-2-(4-methylphenyl)ethanamine
SMILES[H]/N=C(\CNC)c1ccc(C)cc1
InChIInChI=1S/C10H14N2/c1-8-3-5-9(6-4-8)10(11)7-12-2/h3-6,11-12H,7H2,1-2H3/b11-10+
InChIKeyUAUJELFAWDJTGM-ZHACJKMWSA-N
XLogP1.58
TPSA35.88 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 51.58
H-Bond Donors ≤ 52
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 2-imino-N-methyl-2-(4-methylphenyl)ethanamine?
The IUPAC name of 2-imino-N-methyl-2-(4-methylphenyl)ethanamine (CID 142977852) is 2-imino-N-methyl-2-(4-methylphenyl)ethanamine.
What is the SMILES notation for 2-imino-N-methyl-2-(4-methylphenyl)ethanamine?
The canonical SMILES for 2-imino-N-methyl-2-(4-methylphenyl)ethanamine is [H]/N=C(\CNC)c1ccc(C)cc1.
What is the InChIKey of 2-imino-N-methyl-2-(4-methylphenyl)ethanamine?
The InChIKey is UAUJELFAWDJTGM-ZHACJKMWSA-N. The full InChI is InChI=1S/C10H14N2/c1-8-3-5-9(6-4-8)10(11)7-12-2/h3-6,11-12H,7H2,1-2H3/b11-10+.
What are the key properties of 2-imino-N-methyl-2-(4-methylphenyl)ethanamine?
2-imino-N-methyl-2-(4-methylphenyl)ethanamine has a molecular weight of 162.24 g/mol, XLogP of 1.58, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imino-N-methyl-2-(4-methylphenyl)ethanamine is sourced from PubChem (CID 142977852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).