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

C10H15N5O — CID 3041536

IUPAC2-[ethyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol
SMILESCCN(CCO)c1cc(C)nc2ncnn12
InChIInChI=1S/C10H15N5O/c1-3-14(4-5-16)9-6-8(2)13-10-11-7-12-15(9)10/h6-7,16H,3-5H2,1-2H3
InChIKeyICMRDUVKIVZZMD-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.25
Rot. Bonds4

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

2-[ethyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol (PubChem CID 3041536) has the molecular formula C10H15N5O and a molecular weight of 221.26 g/mol. Its IUPAC name is 2-[ethyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol.

Molecular Properties

Compound Name2-[ethyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol
PubChem CID3041536
Molecular FormulaC10H15N5O
Molecular Weight221.26 g/mol
Exact Mass221.13
IUPAC Name2-[ethyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol
SMILESCCN(CCO)c1cc(C)nc2ncnn12
InChIInChI=1S/C10H15N5O/c1-3-14(4-5-16)9-6-8(2)13-10-11-7-12-15(9)10/h6-7,16H,3-5H2,1-2H3
InChIKeyICMRDUVKIVZZMD-UHFFFAOYSA-N
XLogP0.25
TPSA66.55 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol?
The IUPAC name of 2-[ethyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol (CID 3041536) is 2-[ethyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol.
What is the SMILES notation for 2-[ethyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol?
The canonical SMILES for 2-[ethyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol is CCN(CCO)c1cc(C)nc2ncnn12.
What is the InChIKey of 2-[ethyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol?
The InChIKey is ICMRDUVKIVZZMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O/c1-3-14(4-5-16)9-6-8(2)13-10-11-7-12-15(9)10/h6-7,16H,3-5H2,1-2H3.
What are the key properties of 2-[ethyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol?
2-[ethyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol has a molecular weight of 221.26 g/mol, XLogP of 0.25, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]ethanol is sourced from PubChem (CID 3041536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).