3-(aminomethyl)-N-(2-ethoxyethyl)-N-methylpyridin-4-amine

C11H19N3O — CID 81248237

IUPAC3-(aminomethyl)-N-(2-ethoxyethyl)-N-methylpyridin-4-amine
SMILESCCOCCN(C)c1ccncc1CN
InChIInChI=1S/C11H19N3O/c1-3-15-7-6-14(2)11-4-5-13-9-10(11)8-12/h4-5,9H,3,6-8,12H2,1-2H3
InChIKeyTXBRINRWJPQEJY-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.01
Rot. Bonds6

About 3-(aminomethyl)-N-(2-ethoxyethyl)-N-methylpyridin-4-amine

3-(aminomethyl)-N-(2-ethoxyethyl)-N-methylpyridin-4-amine (PubChem CID 81248237) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 3-(aminomethyl)-N-(2-ethoxyethyl)-N-methylpyridin-4-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N-(2-ethoxyethyl)-N-methylpyridin-4-amine
PubChem CID81248237
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name3-(aminomethyl)-N-(2-ethoxyethyl)-N-methylpyridin-4-amine
SMILESCCOCCN(C)c1ccncc1CN
InChIInChI=1S/C11H19N3O/c1-3-15-7-6-14(2)11-4-5-13-9-10(11)8-12/h4-5,9H,3,6-8,12H2,1-2H3
InChIKeyTXBRINRWJPQEJY-UHFFFAOYSA-N
XLogP1.01
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-(aminomethyl)-N,N-bis(2-ethoxyethyl)pyridin-4-amine
CID 82952880
[4-[2-ethoxyethyl(methyl)amino]-3-pyridinyl]methanol
CID 81237193
N-(2-ethoxyethyl)-N-methyl-3-(propylaminomethyl)pyridin-4-amine
CID 81247682
3-(aminomethyl)-N-methyl-N-pentylpyridin-4-amine
CID 81248532
3-(aminomethyl)-N-(2,2-dimethylpropyl)-N-methylpyridin-4-amine
CID 81246543
3-(aminomethyl)-N-methyl-N-propan-2-ylpyridin-4-amine
CID 81249725
3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyridin-4-amine
CID 81246480
3-(aminomethyl)-N-propan-2-yl-N-propylpyridin-4-amine
CID 81248637
N-(2-ethoxyethyl)-N-methyl-8-nitroisoquinolin-5-amine
CID 133446090
4-N-(2-methoxyethyl)-4-N-methylpyridine-3,4-diamine
CID 61360000
4-N-methyl-4-N-[2-(3-methylbutoxy)ethyl]pyridine-3,4-diamine
CID 54956565
3-(aminomethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyridin-4-amine
CID 81246090

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N-(2-ethoxyethyl)-N-methylpyridin-4-amine?
The IUPAC name of 3-(aminomethyl)-N-(2-ethoxyethyl)-N-methylpyridin-4-amine (CID 81248237) is 3-(aminomethyl)-N-(2-ethoxyethyl)-N-methylpyridin-4-amine.
What is the SMILES notation for 3-(aminomethyl)-N-(2-ethoxyethyl)-N-methylpyridin-4-amine?
The canonical SMILES for 3-(aminomethyl)-N-(2-ethoxyethyl)-N-methylpyridin-4-amine is CCOCCN(C)c1ccncc1CN.
What is the InChIKey of 3-(aminomethyl)-N-(2-ethoxyethyl)-N-methylpyridin-4-amine?
The InChIKey is TXBRINRWJPQEJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-3-15-7-6-14(2)11-4-5-13-9-10(11)8-12/h4-5,9H,3,6-8,12H2,1-2H3.
What are the key properties of 3-(aminomethyl)-N-(2-ethoxyethyl)-N-methylpyridin-4-amine?
3-(aminomethyl)-N-(2-ethoxyethyl)-N-methylpyridin-4-amine has a molecular weight of 209.29 g/mol, XLogP of 1.01, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N-(2-ethoxyethyl)-N-methylpyridin-4-amine is sourced from PubChem (CID 81248237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).