2-(2-methoxyethyl)-1H-pyridine-2,4-diamine

C8H15N3O — CID 68547041

IUPAC2-(2-methoxyethyl)-1H-pyridine-2,4-diamine
SMILESCOCCC1(N)C=C(N)C=CN1
InChIInChI=1S/C8H15N3O/c1-12-5-3-8(10)6-7(9)2-4-11-8/h2,4,6,11H,3,5,9-10H2,1H3
InChIKeyCHYZNBWQVGIMQT-UHFFFAOYSA-N
MW169.23 g/mol
LogP-0.36
Rot. Bonds3

About 2-(2-methoxyethyl)-1H-pyridine-2,4-diamine

2-(2-methoxyethyl)-1H-pyridine-2,4-diamine (PubChem CID 68547041) has the molecular formula C8H15N3O and a molecular weight of 169.23 g/mol. Its IUPAC name is 2-(2-methoxyethyl)-1H-pyridine-2,4-diamine.

Molecular Properties

Compound Name2-(2-methoxyethyl)-1H-pyridine-2,4-diamine
PubChem CID68547041
Molecular FormulaC8H15N3O
Molecular Weight169.23 g/mol
Exact Mass169.12
IUPAC Name2-(2-methoxyethyl)-1H-pyridine-2,4-diamine
SMILESCOCCC1(N)C=C(N)C=CN1
InChIInChI=1S/C8H15N3O/c1-12-5-3-8(10)6-7(9)2-4-11-8/h2,4,6,11H,3,5,9-10H2,1H3
InChIKeyCHYZNBWQVGIMQT-UHFFFAOYSA-N
XLogP-0.36
TPSA73.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.23
LogP ≤ 5-0.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethyl)-1H-pyridine-2,4-diamine?
The IUPAC name of 2-(2-methoxyethyl)-1H-pyridine-2,4-diamine (CID 68547041) is 2-(2-methoxyethyl)-1H-pyridine-2,4-diamine.
What is the SMILES notation for 2-(2-methoxyethyl)-1H-pyridine-2,4-diamine?
The canonical SMILES for 2-(2-methoxyethyl)-1H-pyridine-2,4-diamine is COCCC1(N)C=C(N)C=CN1.
What is the InChIKey of 2-(2-methoxyethyl)-1H-pyridine-2,4-diamine?
The InChIKey is CHYZNBWQVGIMQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O/c1-12-5-3-8(10)6-7(9)2-4-11-8/h2,4,6,11H,3,5,9-10H2,1H3.
What are the key properties of 2-(2-methoxyethyl)-1H-pyridine-2,4-diamine?
2-(2-methoxyethyl)-1H-pyridine-2,4-diamine has a molecular weight of 169.23 g/mol, XLogP of -0.36, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethyl)-1H-pyridine-2,4-diamine is sourced from PubChem (CID 68547041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).