2-[5-(methylamino)pyrazol-1-yl]ethanol

C6H11N3O — CID 83872360

IUPAC2-[5-(methylamino)pyrazol-1-yl]ethanol
SMILESCNc1ccnn1CCO
InChIInChI=1S/C6H11N3O/c1-7-6-2-3-8-9(6)4-5-10/h2-3,7,10H,4-5H2,1H3
InChIKeyLNCLFWWDYGBAQQ-UHFFFAOYSA-N
MW141.17 g/mol
LogP-0.08
Rot. Bonds3

About 2-[5-(methylamino)pyrazol-1-yl]ethanol

2-[5-(methylamino)pyrazol-1-yl]ethanol (PubChem CID 83872360) has the molecular formula C6H11N3O and a molecular weight of 141.17 g/mol. Its IUPAC name is 2-[5-(methylamino)pyrazol-1-yl]ethanol.

Molecular Properties

Compound Name2-[5-(methylamino)pyrazol-1-yl]ethanol
PubChem CID83872360
Molecular FormulaC6H11N3O
Molecular Weight141.17 g/mol
Exact Mass141.09
IUPAC Name2-[5-(methylamino)pyrazol-1-yl]ethanol
SMILESCNc1ccnn1CCO
InChIInChI=1S/C6H11N3O/c1-7-6-2-3-8-9(6)4-5-10/h2-3,7,10H,4-5H2,1H3
InChIKeyLNCLFWWDYGBAQQ-UHFFFAOYSA-N
XLogP-0.08
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 5-0.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(methylamino)pyrazol-1-yl]ethanol?
The IUPAC name of 2-[5-(methylamino)pyrazol-1-yl]ethanol (CID 83872360) is 2-[5-(methylamino)pyrazol-1-yl]ethanol.
What is the SMILES notation for 2-[5-(methylamino)pyrazol-1-yl]ethanol?
The canonical SMILES for 2-[5-(methylamino)pyrazol-1-yl]ethanol is CNc1ccnn1CCO.
What is the InChIKey of 2-[5-(methylamino)pyrazol-1-yl]ethanol?
The InChIKey is LNCLFWWDYGBAQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O/c1-7-6-2-3-8-9(6)4-5-10/h2-3,7,10H,4-5H2,1H3.
What are the key properties of 2-[5-(methylamino)pyrazol-1-yl]ethanol?
2-[5-(methylamino)pyrazol-1-yl]ethanol has a molecular weight of 141.17 g/mol, XLogP of -0.08, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(methylamino)pyrazol-1-yl]ethanol is sourced from PubChem (CID 83872360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).