2-ethoxy-6-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine

C13H18N4O — CID 61225341

IUPAC2-ethoxy-6-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine
SMILESCCOc1nc(-n2nc(C)c(C)c2C)ccc1N
InChIInChI=1S/C13H18N4O/c1-5-18-13-11(14)6-7-12(15-13)17-10(4)8(2)9(3)16-17/h6-7H,5,14H2,1-4H3
InChIKeyMRKWNLHFUCHZIO-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.17
Rot. Bonds3

About 2-ethoxy-6-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine

2-ethoxy-6-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine (PubChem CID 61225341) has the molecular formula C13H18N4O and a molecular weight of 246.31 g/mol. Its IUPAC name is 2-ethoxy-6-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine.

Molecular Properties

Compound Name2-ethoxy-6-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine
PubChem CID61225341
Molecular FormulaC13H18N4O
Molecular Weight246.31 g/mol
Exact Mass246.15
IUPAC Name2-ethoxy-6-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine
SMILESCCOc1nc(-n2nc(C)c(C)c2C)ccc1N
InChIInChI=1S/C13H18N4O/c1-5-18-13-11(14)6-7-12(15-13)17-10(4)8(2)9(3)16-17/h6-7H,5,14H2,1-4H3
InChIKeyMRKWNLHFUCHZIO-UHFFFAOYSA-N
XLogP2.17
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-6-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine?
The IUPAC name of 2-ethoxy-6-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine (CID 61225341) is 2-ethoxy-6-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine.
What is the SMILES notation for 2-ethoxy-6-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine?
The canonical SMILES for 2-ethoxy-6-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine is CCOc1nc(-n2nc(C)c(C)c2C)ccc1N.
What is the InChIKey of 2-ethoxy-6-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine?
The InChIKey is MRKWNLHFUCHZIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O/c1-5-18-13-11(14)6-7-12(15-13)17-10(4)8(2)9(3)16-17/h6-7H,5,14H2,1-4H3.
What are the key properties of 2-ethoxy-6-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine?
2-ethoxy-6-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine has a molecular weight of 246.31 g/mol, XLogP of 2.17, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-6-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine is sourced from PubChem (CID 61225341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).