2-[2-[2-(2-methylpyrazol-3-yl)ethylamino]ethoxy]ethanol

C10H19N3O2 — CID 103001295

IUPAC2-[2-[2-(2-methylpyrazol-3-yl)ethylamino]ethoxy]ethanol
SMILESCn1nccc1CCNCCOCCO
InChIInChI=1S/C10H19N3O2/c1-13-10(3-5-12-13)2-4-11-6-8-15-9-7-14/h3,5,11,14H,2,4,6-9H2,1H3
InChIKeyIOVBLUWGZLXBGH-UHFFFAOYSA-N
MW213.28 g/mol
LogP-0.44
Rot. Bonds8

About 2-[2-[2-(2-methylpyrazol-3-yl)ethylamino]ethoxy]ethanol

2-[2-[2-(2-methylpyrazol-3-yl)ethylamino]ethoxy]ethanol (PubChem CID 103001295) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is 2-[2-[2-(2-methylpyrazol-3-yl)ethylamino]ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-[2-(2-methylpyrazol-3-yl)ethylamino]ethoxy]ethanol
PubChem CID103001295
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC Name2-[2-[2-(2-methylpyrazol-3-yl)ethylamino]ethoxy]ethanol
SMILESCn1nccc1CCNCCOCCO
InChIInChI=1S/C10H19N3O2/c1-13-10(3-5-12-13)2-4-11-6-8-15-9-7-14/h3,5,11,14H,2,4,6-9H2,1H3
InChIKeyIOVBLUWGZLXBGH-UHFFFAOYSA-N
XLogP-0.44
TPSA59.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 5-0.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-(2-methylpyrazol-3-yl)ethanamine
CID 103006076
2-(2-methylpyrazol-3-yl)-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanamine
CID 103001408
N-[2-[2-(2-methylpyrazol-3-yl)ethoxy]ethyl]propan-1-amine
CID 103004060
4-[2-(2-methylpyrazol-3-yl)ethylamino]butan-1-ol
CID 103005787
2-(2-methylpyrazol-3-yl)-N-(2-propan-2-yloxyethyl)ethanamine
CID 103002048
6-[2-(2-methylpyrazol-3-yl)ethylamino]hexan-1-ol
CID 107703692
2-[(2-methylpyrazol-3-yl)methoxy]ethanol
CID 164538456
2-[2-[(2-ethylpyrazol-3-yl)methylamino]ethoxy]ethanol
CID 75525234
N',N'-dimethyl-N-[2-(2-methylpyrazol-3-yl)ethyl]propane-1,3-diamine
CID 103000722
4-bromo-N-[2-(2-methylpyrazol-3-yl)ethyl]butan-1-amine
CID 106844750
2-[2-[2-(2-methylpyrazol-3-yl)ethylamino]ethoxy]benzoic acid
CID 103268835
2-[2-(2-butoxyethoxy)ethoxy]-N-[(2-methylpyrazol-3-yl)methyl]ethanamine
CID 104562263

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(2-methylpyrazol-3-yl)ethylamino]ethoxy]ethanol?
The IUPAC name of 2-[2-[2-(2-methylpyrazol-3-yl)ethylamino]ethoxy]ethanol (CID 103001295) is 2-[2-[2-(2-methylpyrazol-3-yl)ethylamino]ethoxy]ethanol.
What is the SMILES notation for 2-[2-[2-(2-methylpyrazol-3-yl)ethylamino]ethoxy]ethanol?
The canonical SMILES for 2-[2-[2-(2-methylpyrazol-3-yl)ethylamino]ethoxy]ethanol is Cn1nccc1CCNCCOCCO.
What is the InChIKey of 2-[2-[2-(2-methylpyrazol-3-yl)ethylamino]ethoxy]ethanol?
The InChIKey is IOVBLUWGZLXBGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c1-13-10(3-5-12-13)2-4-11-6-8-15-9-7-14/h3,5,11,14H,2,4,6-9H2,1H3.
What are the key properties of 2-[2-[2-(2-methylpyrazol-3-yl)ethylamino]ethoxy]ethanol?
2-[2-[2-(2-methylpyrazol-3-yl)ethylamino]ethoxy]ethanol has a molecular weight of 213.28 g/mol, XLogP of -0.44, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(2-methylpyrazol-3-yl)ethylamino]ethoxy]ethanol is sourced from PubChem (CID 103001295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).