6-(2-butoxyethoxymethyl)pyridin-2-amine

C12H20N2O2 — CID 79238771

IUPAC6-(2-butoxyethoxymethyl)pyridin-2-amine
SMILESCCCCOCCOCc1cccc(N)n1
InChIInChI=1S/C12H20N2O2/c1-2-3-7-15-8-9-16-10-11-5-4-6-12(13)14-11/h4-6H,2-3,7-10H2,1H3,(H2,13,14)
InChIKeyRYBJOZSJVYQNJS-UHFFFAOYSA-N
MW224.30 g/mol
LogP2.00
Rot. Bonds8

About 6-(2-butoxyethoxymethyl)pyridin-2-amine

6-(2-butoxyethoxymethyl)pyridin-2-amine (PubChem CID 79238771) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is 6-(2-butoxyethoxymethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-(2-butoxyethoxymethyl)pyridin-2-amine
PubChem CID79238771
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name6-(2-butoxyethoxymethyl)pyridin-2-amine
SMILESCCCCOCCOCc1cccc(N)n1
InChIInChI=1S/C12H20N2O2/c1-2-3-7-15-8-9-16-10-11-5-4-6-12(13)14-11/h4-6H,2-3,7-10H2,1H3,(H2,13,14)
InChIKeyRYBJOZSJVYQNJS-UHFFFAOYSA-N
XLogP2.00
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 52.00
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

6-[2-[2-[(6-amino-2-pyridinyl)methoxy]ethoxy]ethoxymethyl]pyridin-2-amine
CID 102588999
6-(4,4,4-trifluorobutoxymethyl)pyridin-2-amine
CID 82792739
N-[[6-(2-butoxyethoxymethyl)-2-pyridinyl]methyl]propan-1-amine
CID 106907746
4-(2-butoxyethoxymethyl)-1,3-thiazol-2-amine
CID 43137916
[6-[3-(2-methoxyethoxy)propoxymethyl]-2-pyridinyl]methanamine
CID 106908742
6-(pentoxymethyl)-N-propylpyridin-2-amine
CID 79238780
6-[(2-methylpropan-2-yl)oxymethyl]pyridin-2-amine
CID 79239110
6-(heptoxymethyl)pyridine-2-carboxylic acid
CID 106903282
N-[[6-(hexoxymethyl)-2-pyridinyl]methyl]propan-1-amine
CID 106907788
butoxymethylbenzene;phenylmethanamine
CID 142079106
6-[(3-methoxyphenyl)methoxymethyl]pyridin-2-amine
CID 79240022
6-[2-(2-methoxyethoxy)ethoxymethyl]-N-propylpyridin-2-amine
CID 104565921

Frequently Asked Questions

What is the IUPAC name of 6-(2-butoxyethoxymethyl)pyridin-2-amine?
The IUPAC name of 6-(2-butoxyethoxymethyl)pyridin-2-amine (CID 79238771) is 6-(2-butoxyethoxymethyl)pyridin-2-amine.
What is the SMILES notation for 6-(2-butoxyethoxymethyl)pyridin-2-amine?
The canonical SMILES for 6-(2-butoxyethoxymethyl)pyridin-2-amine is CCCCOCCOCc1cccc(N)n1.
What is the InChIKey of 6-(2-butoxyethoxymethyl)pyridin-2-amine?
The InChIKey is RYBJOZSJVYQNJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-2-3-7-15-8-9-16-10-11-5-4-6-12(13)14-11/h4-6H,2-3,7-10H2,1H3,(H2,13,14).
What are the key properties of 6-(2-butoxyethoxymethyl)pyridin-2-amine?
6-(2-butoxyethoxymethyl)pyridin-2-amine has a molecular weight of 224.30 g/mol, XLogP of 2.00, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-butoxyethoxymethyl)pyridin-2-amine is sourced from PubChem (CID 79238771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).