2-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)oxyethanamine

C8H11N5O — CID 62348679

IUPAC2-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)oxyethanamine
SMILESCn1ncc2c(OCCN)ncnc21
InChIInChI=1S/C8H11N5O/c1-13-7-6(4-12-13)8(11-5-10-7)14-3-2-9/h4-5H,2-3,9H2,1H3
InChIKeyWZCGFJBAVMNYQM-UHFFFAOYSA-N
MW193.21 g/mol
LogP-0.30
Rot. Bonds3

About 2-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)oxyethanamine

2-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)oxyethanamine (PubChem CID 62348679) has the molecular formula C8H11N5O and a molecular weight of 193.21 g/mol. Its IUPAC name is 2-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)oxyethanamine.

Molecular Properties

Compound Name2-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)oxyethanamine
PubChem CID62348679
Molecular FormulaC8H11N5O
Molecular Weight193.21 g/mol
Exact Mass193.10
IUPAC Name2-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)oxyethanamine
SMILESCn1ncc2c(OCCN)ncnc21
InChIInChI=1S/C8H11N5O/c1-13-7-6(4-12-13)8(11-5-10-7)14-3-2-9/h4-5H,2-3,9H2,1H3
InChIKeyWZCGFJBAVMNYQM-UHFFFAOYSA-N
XLogP-0.30
TPSA78.85 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 5-0.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)oxyethanamine?
The IUPAC name of 2-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)oxyethanamine (CID 62348679) is 2-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)oxyethanamine.
What is the SMILES notation for 2-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)oxyethanamine?
The canonical SMILES for 2-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)oxyethanamine is Cn1ncc2c(OCCN)ncnc21.
What is the InChIKey of 2-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)oxyethanamine?
The InChIKey is WZCGFJBAVMNYQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N5O/c1-13-7-6(4-12-13)8(11-5-10-7)14-3-2-9/h4-5H,2-3,9H2,1H3.
What are the key properties of 2-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)oxyethanamine?
2-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)oxyethanamine has a molecular weight of 193.21 g/mol, XLogP of -0.30, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)oxyethanamine is sourced from PubChem (CID 62348679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).