6-[2-[2-[(5-amino-2-pyridinyl)oxy]ethoxy]ethoxy]pyridin-3-amine

C14H18N4O3 — CID 153301404

IUPAC6-[2-[2-[(5-amino-2-pyridinyl)oxy]ethoxy]ethoxy]pyridin-3-amine
SMILESNc1ccc(OCCOCCOc2ccc(N)cn2)nc1
InChIInChI=1S/C14H18N4O3/c15-11-1-3-13(17-9-11)20-7-5-19-6-8-21-14-4-2-12(16)10-18-14/h1-4,9-10H,5-8,15-16H2
InChIKeyQROPPZRJJXHXDJ-UHFFFAOYSA-N
MW290.32 g/mol
LogP1.12
Rot. Bonds8

About 6-[2-[2-[(5-amino-2-pyridinyl)oxy]ethoxy]ethoxy]pyridin-3-amine

6-[2-[2-[(5-amino-2-pyridinyl)oxy]ethoxy]ethoxy]pyridin-3-amine (PubChem CID 153301404) has the molecular formula C14H18N4O3 and a molecular weight of 290.32 g/mol. Its IUPAC name is 6-[2-[2-[(5-amino-2-pyridinyl)oxy]ethoxy]ethoxy]pyridin-3-amine.

Molecular Properties

Compound Name6-[2-[2-[(5-amino-2-pyridinyl)oxy]ethoxy]ethoxy]pyridin-3-amine
PubChem CID153301404
Molecular FormulaC14H18N4O3
Molecular Weight290.32 g/mol
Exact Mass290.14
IUPAC Name6-[2-[2-[(5-amino-2-pyridinyl)oxy]ethoxy]ethoxy]pyridin-3-amine
SMILESNc1ccc(OCCOCCOc2ccc(N)cn2)nc1
InChIInChI=1S/C14H18N4O3/c15-11-1-3-13(17-9-11)20-7-5-19-6-8-21-14-4-2-12(16)10-18-14/h1-4,9-10H,5-8,15-16H2
InChIKeyQROPPZRJJXHXDJ-UHFFFAOYSA-N
XLogP1.12
TPSA105.51 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-[2-[2-[(5-amino-2-pyridinyl)oxy]ethoxy]ethoxy]pyridin-3-amine?
The IUPAC name of 6-[2-[2-[(5-amino-2-pyridinyl)oxy]ethoxy]ethoxy]pyridin-3-amine (CID 153301404) is 6-[2-[2-[(5-amino-2-pyridinyl)oxy]ethoxy]ethoxy]pyridin-3-amine.
What is the SMILES notation for 6-[2-[2-[(5-amino-2-pyridinyl)oxy]ethoxy]ethoxy]pyridin-3-amine?
The canonical SMILES for 6-[2-[2-[(5-amino-2-pyridinyl)oxy]ethoxy]ethoxy]pyridin-3-amine is Nc1ccc(OCCOCCOc2ccc(N)cn2)nc1.
What is the InChIKey of 6-[2-[2-[(5-amino-2-pyridinyl)oxy]ethoxy]ethoxy]pyridin-3-amine?
The InChIKey is QROPPZRJJXHXDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O3/c15-11-1-3-13(17-9-11)20-7-5-19-6-8-21-14-4-2-12(16)10-18-14/h1-4,9-10H,5-8,15-16H2.
What are the key properties of 6-[2-[2-[(5-amino-2-pyridinyl)oxy]ethoxy]ethoxy]pyridin-3-amine?
6-[2-[2-[(5-amino-2-pyridinyl)oxy]ethoxy]ethoxy]pyridin-3-amine has a molecular weight of 290.32 g/mol, XLogP of 1.12, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-[2-[(5-amino-2-pyridinyl)oxy]ethoxy]ethoxy]pyridin-3-amine is sourced from PubChem (CID 153301404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).