N-(3-ethoxy-2-pyridinyl)-6-methylpyridin-2-amine

C13H15N3O — CID 11368190

IUPACN-(3-ethoxy-2-pyridinyl)-6-methylpyridin-2-amine
SMILESCCOc1cccnc1Nc1cccc(C)n1
InChIInChI=1S/C13H15N3O/c1-3-17-11-7-5-9-14-13(11)16-12-8-4-6-10(2)15-12/h4-9H,3H2,1-2H3,(H,14,15,16)
InChIKeyORDSOSQROZOFQQ-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.93
Rot. Bonds4

About N-(3-ethoxy-2-pyridinyl)-6-methylpyridin-2-amine

N-(3-ethoxy-2-pyridinyl)-6-methylpyridin-2-amine (PubChem CID 11368190) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is N-(3-ethoxy-2-pyridinyl)-6-methylpyridin-2-amine.

Molecular Properties

Compound NameN-(3-ethoxy-2-pyridinyl)-6-methylpyridin-2-amine
PubChem CID11368190
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC NameN-(3-ethoxy-2-pyridinyl)-6-methylpyridin-2-amine
SMILESCCOc1cccnc1Nc1cccc(C)n1
InChIInChI=1S/C13H15N3O/c1-3-17-11-7-5-9-14-13(11)16-12-8-4-6-10(2)15-12/h4-9H,3H2,1-2H3,(H,14,15,16)
InChIKeyORDSOSQROZOFQQ-UHFFFAOYSA-N
XLogP2.93
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxy-2-pyridinyl)-6-methylpyridin-2-amine?
The IUPAC name of N-(3-ethoxy-2-pyridinyl)-6-methylpyridin-2-amine (CID 11368190) is N-(3-ethoxy-2-pyridinyl)-6-methylpyridin-2-amine.
What is the SMILES notation for N-(3-ethoxy-2-pyridinyl)-6-methylpyridin-2-amine?
The canonical SMILES for N-(3-ethoxy-2-pyridinyl)-6-methylpyridin-2-amine is CCOc1cccnc1Nc1cccc(C)n1.
What is the InChIKey of N-(3-ethoxy-2-pyridinyl)-6-methylpyridin-2-amine?
The InChIKey is ORDSOSQROZOFQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c1-3-17-11-7-5-9-14-13(11)16-12-8-4-6-10(2)15-12/h4-9H,3H2,1-2H3,(H,14,15,16).
What are the key properties of N-(3-ethoxy-2-pyridinyl)-6-methylpyridin-2-amine?
N-(3-ethoxy-2-pyridinyl)-6-methylpyridin-2-amine has a molecular weight of 229.28 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxy-2-pyridinyl)-6-methylpyridin-2-amine is sourced from PubChem (CID 11368190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).