3-Methyl-2-(1-piperidinyl)aniline

HCID 69307787

Notes Reactions

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Basic information

Standard SMILES: Cc1cccc(N)c1N1CCCCC1
InChIKey: MCOPUGXVOCIMGY-UHFFFAOYSA-N
Molecular formula: C12H18N2
Average molar mass: 190.28 g/mol

Names & identifiers

Preferred name: 3-Methyl-2-(1-piperidinyl)aniline
IUPAC: 3-methyl-2-piperidin-1-ylaniline

Names & synonyms

84186-30-13-Methyl-2-(1-piperidinyl)aniline3-methyl-2-(piperidin-1-yl)aniline1-(2-AMINO-6-METHYLPHENYL)PIPERIDINE3-methyl-2-piperidin-1-yl-phenylamineMFCD11848985SCHEMBL5092234MCOPUGXVOCIMGY-UHFFFAOYSA-NAC6899AKOS017517072SY237500

Database identifiers

PubChem CID: 69307787

Properties

Computed structural properties

XLogP: 2.6
Topological polar surface area: 29.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 14
Formal charge: 0
Complexity: 175

Related reactions

3 records

New reaction record

HRID 32906As productuspto-grants-2008_09

HRID 32907As reactantuspto-grants-2008_09

HRID 674697As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)

Compound notes

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