3-ethyl-N-[(6-methyl-2-pyridinyl)methyl]aniline

C15H18N2 — CID 79268214

IUPAC3-ethyl-N-[(6-methyl-2-pyridinyl)methyl]aniline
SMILESCCc1cccc(NCc2cccc(C)n2)c1
InChIInChI=1S/C15H18N2/c1-3-13-7-5-8-14(10-13)16-11-15-9-4-6-12(2)17-15/h4-10,16H,3,11H2,1-2H3
InChIKeyRDYAXERQZZEACT-UHFFFAOYSA-N
MW226.32 g/mol
LogP3.56
Rot. Bonds4

About 3-ethyl-N-[(6-methyl-2-pyridinyl)methyl]aniline

3-ethyl-N-[(6-methyl-2-pyridinyl)methyl]aniline (PubChem CID 79268214) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 3-ethyl-N-[(6-methyl-2-pyridinyl)methyl]aniline.

Molecular Properties

Compound Name3-ethyl-N-[(6-methyl-2-pyridinyl)methyl]aniline
PubChem CID79268214
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC Name3-ethyl-N-[(6-methyl-2-pyridinyl)methyl]aniline
SMILESCCc1cccc(NCc2cccc(C)n2)c1
InChIInChI=1S/C15H18N2/c1-3-13-7-5-8-14(10-13)16-11-15-9-4-6-12(2)17-15/h4-10,16H,3,11H2,1-2H3
InChIKeyRDYAXERQZZEACT-UHFFFAOYSA-N
XLogP3.56
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-N-[(6-methyl-2-pyridinyl)methyl]benzene-1,3-diamine
CID 62323012
3,5-dimethyl-N-[(6-methyl-2-pyridinyl)methyl]aniline
CID 79267863
3-ethyl-N-[(2-ethyl-1,3-thiazol-4-yl)methyl]aniline
CID 60727503
N-[(6-methyl-2-pyridinyl)methyl]-2,3-dihydro-1H-inden-5-amine
CID 79268037
2-methyl-4-[(6-methyl-2-pyridinyl)methylamino]benzonitrile
CID 81274208
N-[(3,4-dichlorophenyl)methyl]-3-ethylaniline
CID 29298509
4-[(3-ethylanilino)methyl]-1,3-thiazole-2-carboxylic acid
CID 103236150
2-chloro-N-(3-ethylphenyl)-6-methylpyridin-3-amine
CID 139400879
6-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pyrimidin-4-amine
CID 55057435
3-ethyl-N-[(3-methyl-2-pyridinyl)methyl]aniline
CID 112650029
1-(6-methyl-2-pyridinyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine
CID 15491901
N-[(3,5-dichlorophenyl)methyl]-3-ethylaniline
CID 60788560

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-[(6-methyl-2-pyridinyl)methyl]aniline?
The IUPAC name of 3-ethyl-N-[(6-methyl-2-pyridinyl)methyl]aniline (CID 79268214) is 3-ethyl-N-[(6-methyl-2-pyridinyl)methyl]aniline.
What is the SMILES notation for 3-ethyl-N-[(6-methyl-2-pyridinyl)methyl]aniline?
The canonical SMILES for 3-ethyl-N-[(6-methyl-2-pyridinyl)methyl]aniline is CCc1cccc(NCc2cccc(C)n2)c1.
What is the InChIKey of 3-ethyl-N-[(6-methyl-2-pyridinyl)methyl]aniline?
The InChIKey is RDYAXERQZZEACT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2/c1-3-13-7-5-8-14(10-13)16-11-15-9-4-6-12(2)17-15/h4-10,16H,3,11H2,1-2H3.
What are the key properties of 3-ethyl-N-[(6-methyl-2-pyridinyl)methyl]aniline?
3-ethyl-N-[(6-methyl-2-pyridinyl)methyl]aniline has a molecular weight of 226.32 g/mol, XLogP of 3.56, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-[(6-methyl-2-pyridinyl)methyl]aniline is sourced from PubChem (CID 79268214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).