2-(2-methoxyethyl)-1H-pyridine-2,3-diamine

C8H15N3O — CID 175105703

IUPAC2-(2-methoxyethyl)-1H-pyridine-2,3-diamine
SMILESCOCCC1(N)NC=CC=C1N
InChIInChI=1S/C8H15N3O/c1-12-6-4-8(10)7(9)3-2-5-11-8/h2-3,5,11H,4,6,9-10H2,1H3
InChIKeyLWWZUYHWIGVGLX-UHFFFAOYSA-N
MW169.23 g/mol
LogP-0.36
Rot. Bonds3

About 2-(2-methoxyethyl)-1H-pyridine-2,3-diamine

2-(2-methoxyethyl)-1H-pyridine-2,3-diamine (PubChem CID 175105703) has the molecular formula C8H15N3O and a molecular weight of 169.23 g/mol. Its IUPAC name is 2-(2-methoxyethyl)-1H-pyridine-2,3-diamine.

Molecular Properties

Compound Name2-(2-methoxyethyl)-1H-pyridine-2,3-diamine
PubChem CID175105703
Molecular FormulaC8H15N3O
Molecular Weight169.23 g/mol
Exact Mass169.12
IUPAC Name2-(2-methoxyethyl)-1H-pyridine-2,3-diamine
SMILESCOCCC1(N)NC=CC=C1N
InChIInChI=1S/C8H15N3O/c1-12-6-4-8(10)7(9)3-2-5-11-8/h2-3,5,11H,4,6,9-10H2,1H3
InChIKeyLWWZUYHWIGVGLX-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-2,3-diamine?
The IUPAC name of 2-(2-methoxyethyl)-1H-pyridine-2,3-diamine (CID 175105703) is 2-(2-methoxyethyl)-1H-pyridine-2,3-diamine.
What is the SMILES notation for 2-(2-methoxyethyl)-1H-pyridine-2,3-diamine?
The canonical SMILES for 2-(2-methoxyethyl)-1H-pyridine-2,3-diamine is COCCC1(N)NC=CC=C1N.
What is the InChIKey of 2-(2-methoxyethyl)-1H-pyridine-2,3-diamine?
The InChIKey is LWWZUYHWIGVGLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O/c1-12-6-4-8(10)7(9)3-2-5-11-8/h2-3,5,11H,4,6,9-10H2,1H3.
What are the key properties of 2-(2-methoxyethyl)-1H-pyridine-2,3-diamine?
2-(2-methoxyethyl)-1H-pyridine-2,3-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-2,3-diamine is sourced from PubChem (CID 175105703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).