[3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-pyridinyl]methanamine

C14H17N3O — CID 103174319

IUPAC[3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-pyridinyl]methanamine
SMILESCCc1nc(C)ccc1Oc1cccnc1CN
InChIInChI=1S/C14H17N3O/c1-3-11-14(7-6-10(2)17-11)18-13-5-4-8-16-12(13)9-15/h4-8H,3,9,15H2,1-2H3
InChIKeyFXTQJLPUIYRIIP-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.60
Rot. Bonds4

About [3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-pyridinyl]methanamine

[3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-pyridinyl]methanamine (PubChem CID 103174319) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is [3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-pyridinyl]methanamine
PubChem CID103174319
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC Name[3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-pyridinyl]methanamine
SMILESCCc1nc(C)ccc1Oc1cccnc1CN
InChIInChI=1S/C14H17N3O/c1-3-11-14(7-6-10(2)17-11)18-13-5-4-8-16-12(13)9-15/h4-8H,3,9,15H2,1-2H3
InChIKeyFXTQJLPUIYRIIP-UHFFFAOYSA-N
XLogP2.60
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-pyridinyl]methanamine?
The IUPAC name of [3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-pyridinyl]methanamine (CID 103174319) is [3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-pyridinyl]methanamine.
What is the SMILES notation for [3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-pyridinyl]methanamine?
The canonical SMILES for [3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-pyridinyl]methanamine is CCc1nc(C)ccc1Oc1cccnc1CN.
What is the InChIKey of [3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-pyridinyl]methanamine?
The InChIKey is FXTQJLPUIYRIIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-3-11-14(7-6-10(2)17-11)18-13-5-4-8-16-12(13)9-15/h4-8H,3,9,15H2,1-2H3.
What are the key properties of [3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-pyridinyl]methanamine?
[3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-pyridinyl]methanamine has a molecular weight of 243.31 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-pyridinyl]methanamine is sourced from PubChem (CID 103174319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).