3-ethoxy-2-methylpyrazolo[4,3-d]pyrimidin-7-amine

C8H11N5O — CID 66630414

IUPAC3-ethoxy-2-methylpyrazolo[4,3-d]pyrimidin-7-amine
SMILESCCOc1c2ncnc(N)c2nn1C
InChIInChI=1S/C8H11N5O/c1-3-14-8-6-5(12-13(8)2)7(9)11-4-10-6/h4H,3H2,1-2H3,(H2,9,10,11)
InChIKeyWLAARGKUGRFNFW-UHFFFAOYSA-N
MW193.21 g/mol
LogP0.34
Rot. Bonds2

About 3-ethoxy-2-methylpyrazolo[4,3-d]pyrimidin-7-amine

3-ethoxy-2-methylpyrazolo[4,3-d]pyrimidin-7-amine (PubChem CID 66630414) has the molecular formula C8H11N5O and a molecular weight of 193.21 g/mol. Its IUPAC name is 3-ethoxy-2-methylpyrazolo[4,3-d]pyrimidin-7-amine.

Molecular Properties

Compound Name3-ethoxy-2-methylpyrazolo[4,3-d]pyrimidin-7-amine
PubChem CID66630414
Molecular FormulaC8H11N5O
Molecular Weight193.21 g/mol
Exact Mass193.10
IUPAC Name3-ethoxy-2-methylpyrazolo[4,3-d]pyrimidin-7-amine
SMILESCCOc1c2ncnc(N)c2nn1C
InChIInChI=1S/C8H11N5O/c1-3-14-8-6-5(12-13(8)2)7(9)11-4-10-6/h4H,3H2,1-2H3,(H2,9,10,11)
InChIKeyWLAARGKUGRFNFW-UHFFFAOYSA-N
XLogP0.34
TPSA78.85 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-2-methylpyrazolo[4,3-d]pyrimidin-7-amine?
The IUPAC name of 3-ethoxy-2-methylpyrazolo[4,3-d]pyrimidin-7-amine (CID 66630414) is 3-ethoxy-2-methylpyrazolo[4,3-d]pyrimidin-7-amine.
What is the SMILES notation for 3-ethoxy-2-methylpyrazolo[4,3-d]pyrimidin-7-amine?
The canonical SMILES for 3-ethoxy-2-methylpyrazolo[4,3-d]pyrimidin-7-amine is CCOc1c2ncnc(N)c2nn1C.
What is the InChIKey of 3-ethoxy-2-methylpyrazolo[4,3-d]pyrimidin-7-amine?
The InChIKey is WLAARGKUGRFNFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N5O/c1-3-14-8-6-5(12-13(8)2)7(9)11-4-10-6/h4H,3H2,1-2H3,(H2,9,10,11).
What are the key properties of 3-ethoxy-2-methylpyrazolo[4,3-d]pyrimidin-7-amine?
3-ethoxy-2-methylpyrazolo[4,3-d]pyrimidin-7-amine has a molecular weight of 193.21 g/mol, XLogP of 0.34, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-2-methylpyrazolo[4,3-d]pyrimidin-7-amine is sourced from PubChem (CID 66630414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).