2-[(1-methylpyrazol-3-yl)amino]ethanol

C6H11N3O — CID 23443606

IUPAC2-[(1-methylpyrazol-3-yl)amino]ethanol
SMILESCn1ccc(NCCO)n1
InChIInChI=1S/C6H11N3O/c1-9-4-2-6(8-9)7-3-5-10/h2,4,10H,3,5H2,1H3,(H,7,8)
InChIKeyMKUPKEBJQLIRMK-UHFFFAOYSA-N
MW141.17 g/mol
LogP-0.18
Rot. Bonds3

About 2-[(1-methylpyrazol-3-yl)amino]ethanol

2-[(1-methylpyrazol-3-yl)amino]ethanol (PubChem CID 23443606) has the molecular formula C6H11N3O and a molecular weight of 141.17 g/mol. Its IUPAC name is 2-[(1-methylpyrazol-3-yl)amino]ethanol.

Molecular Properties

Compound Name2-[(1-methylpyrazol-3-yl)amino]ethanol
PubChem CID23443606
Molecular FormulaC6H11N3O
Molecular Weight141.17 g/mol
Exact Mass141.09
IUPAC Name2-[(1-methylpyrazol-3-yl)amino]ethanol
SMILESCn1ccc(NCCO)n1
InChIInChI=1S/C6H11N3O/c1-9-4-2-6(8-9)7-3-5-10/h2,4,10H,3,5H2,1H3,(H,7,8)
InChIKeyMKUPKEBJQLIRMK-UHFFFAOYSA-N
XLogP-0.18
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 ≤ 5-0.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(1-methylpyrazol-3-yl)amino]ethanol?
The IUPAC name of 2-[(1-methylpyrazol-3-yl)amino]ethanol (CID 23443606) is 2-[(1-methylpyrazol-3-yl)amino]ethanol.
What is the SMILES notation for 2-[(1-methylpyrazol-3-yl)amino]ethanol?
The canonical SMILES for 2-[(1-methylpyrazol-3-yl)amino]ethanol is Cn1ccc(NCCO)n1.
What is the InChIKey of 2-[(1-methylpyrazol-3-yl)amino]ethanol?
The InChIKey is MKUPKEBJQLIRMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O/c1-9-4-2-6(8-9)7-3-5-10/h2,4,10H,3,5H2,1H3,(H,7,8).
What are the key properties of 2-[(1-methylpyrazol-3-yl)amino]ethanol?
2-[(1-methylpyrazol-3-yl)amino]ethanol has a molecular weight of 141.17 g/mol, XLogP of -0.18, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-methylpyrazol-3-yl)amino]ethanol is sourced from PubChem (CID 23443606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).