6-(2-methoxyethoxy)-N-[1-(2-methylpyrazol-3-yl)ethyl]pyridin-3-amine

C14H20N4O2 — CID 106757206

IUPAC6-(2-methoxyethoxy)-N-[1-(2-methylpyrazol-3-yl)ethyl]pyridin-3-amine
SMILESCOCCOc1ccc(NC(C)c2ccnn2C)cn1
InChIInChI=1S/C14H20N4O2/c1-11(13-6-7-16-18(13)2)17-12-4-5-14(15-10-12)20-9-8-19-3/h4-7,10-11,17H,8-9H2,1-3H3
InChIKeyRRMXUWRRQIMQDC-UHFFFAOYSA-N
MW276.34 g/mol
LogP2.01
Rot. Bonds7

About 6-(2-methoxyethoxy)-N-[1-(2-methylpyrazol-3-yl)ethyl]pyridin-3-amine

6-(2-methoxyethoxy)-N-[1-(2-methylpyrazol-3-yl)ethyl]pyridin-3-amine (PubChem CID 106757206) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is 6-(2-methoxyethoxy)-N-[1-(2-methylpyrazol-3-yl)ethyl]pyridin-3-amine.

Molecular Properties

Compound Name6-(2-methoxyethoxy)-N-[1-(2-methylpyrazol-3-yl)ethyl]pyridin-3-amine
PubChem CID106757206
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC Name6-(2-methoxyethoxy)-N-[1-(2-methylpyrazol-3-yl)ethyl]pyridin-3-amine
SMILESCOCCOc1ccc(NC(C)c2ccnn2C)cn1
InChIInChI=1S/C14H20N4O2/c1-11(13-6-7-16-18(13)2)17-12-4-5-14(15-10-12)20-9-8-19-3/h4-7,10-11,17H,8-9H2,1-3H3
InChIKeyRRMXUWRRQIMQDC-UHFFFAOYSA-N
XLogP2.01
TPSA61.20 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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-methoxyethoxy)-N-[1-(2-methylpyrazol-3-yl)ethyl]pyridin-3-amine?
The IUPAC name of 6-(2-methoxyethoxy)-N-[1-(2-methylpyrazol-3-yl)ethyl]pyridin-3-amine (CID 106757206) is 6-(2-methoxyethoxy)-N-[1-(2-methylpyrazol-3-yl)ethyl]pyridin-3-amine.
What is the SMILES notation for 6-(2-methoxyethoxy)-N-[1-(2-methylpyrazol-3-yl)ethyl]pyridin-3-amine?
The canonical SMILES for 6-(2-methoxyethoxy)-N-[1-(2-methylpyrazol-3-yl)ethyl]pyridin-3-amine is COCCOc1ccc(NC(C)c2ccnn2C)cn1.
What is the InChIKey of 6-(2-methoxyethoxy)-N-[1-(2-methylpyrazol-3-yl)ethyl]pyridin-3-amine?
The InChIKey is RRMXUWRRQIMQDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-11(13-6-7-16-18(13)2)17-12-4-5-14(15-10-12)20-9-8-19-3/h4-7,10-11,17H,8-9H2,1-3H3.
What are the key properties of 6-(2-methoxyethoxy)-N-[1-(2-methylpyrazol-3-yl)ethyl]pyridin-3-amine?
6-(2-methoxyethoxy)-N-[1-(2-methylpyrazol-3-yl)ethyl]pyridin-3-amine has a molecular weight of 276.34 g/mol, XLogP of 2.01, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methoxyethoxy)-N-[1-(2-methylpyrazol-3-yl)ethyl]pyridin-3-amine is sourced from PubChem (CID 106757206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).