2-[cyclopropyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol

C11H15N5O — CID 61147154

IUPAC2-[cyclopropyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol
SMILESCc1cc(N(CCO)C2CC2)n2ncnc2n1
InChIInChI=1S/C11H15N5O/c1-8-6-10(15(4-5-17)9-2-3-9)16-11(14-8)12-7-13-16/h6-7,9,17H,2-5H2,1H3
InChIKeyDFZJRPWFYDTHLA-UHFFFAOYSA-N
MW233.27 g/mol
LogP0.39
Rot. Bonds4

About 2-[cyclopropyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol

2-[cyclopropyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol (PubChem CID 61147154) has the molecular formula C11H15N5O and a molecular weight of 233.27 g/mol. Its IUPAC name is 2-[cyclopropyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol.

Molecular Properties

Compound Name2-[cyclopropyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol
PubChem CID61147154
Molecular FormulaC11H15N5O
Molecular Weight233.27 g/mol
Exact Mass233.13
IUPAC Name2-[cyclopropyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol
SMILESCc1cc(N(CCO)C2CC2)n2ncnc2n1
InChIInChI=1S/C11H15N5O/c1-8-6-10(15(4-5-17)9-2-3-9)16-11(14-8)12-7-13-16/h6-7,9,17H,2-5H2,1H3
InChIKeyDFZJRPWFYDTHLA-UHFFFAOYSA-N
XLogP0.39
TPSA66.55 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol?
The IUPAC name of 2-[cyclopropyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol (CID 61147154) is 2-[cyclopropyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol.
What is the SMILES notation for 2-[cyclopropyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol?
The canonical SMILES for 2-[cyclopropyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol is Cc1cc(N(CCO)C2CC2)n2ncnc2n1.
What is the InChIKey of 2-[cyclopropyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol?
The InChIKey is DFZJRPWFYDTHLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c1-8-6-10(15(4-5-17)9-2-3-9)16-11(14-8)12-7-13-16/h6-7,9,17H,2-5H2,1H3.
What are the key properties of 2-[cyclopropyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol?
2-[cyclopropyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol has a molecular weight of 233.27 g/mol, XLogP of 0.39, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol is sourced from PubChem (CID 61147154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).