2-(2-methylpyrazol-3-yl)-N-(2-propan-2-yloxyethyl)ethanamine

C11H21N3O — CID 103002048

IUPAC2-(2-methylpyrazol-3-yl)-N-(2-propan-2-yloxyethyl)ethanamine
SMILESCC(C)OCCNCCc1ccnn1C
InChIInChI=1S/C11H21N3O/c1-10(2)15-9-8-12-6-4-11-5-7-13-14(11)3/h5,7,10,12H,4,6,8-9H2,1-3H3
InChIKeyLDLROJZYFJCLPA-UHFFFAOYSA-N
MW211.31 g/mol
LogP0.98
Rot. Bonds7

About 2-(2-methylpyrazol-3-yl)-N-(2-propan-2-yloxyethyl)ethanamine

2-(2-methylpyrazol-3-yl)-N-(2-propan-2-yloxyethyl)ethanamine (PubChem CID 103002048) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 2-(2-methylpyrazol-3-yl)-N-(2-propan-2-yloxyethyl)ethanamine.

Molecular Properties

Compound Name2-(2-methylpyrazol-3-yl)-N-(2-propan-2-yloxyethyl)ethanamine
PubChem CID103002048
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name2-(2-methylpyrazol-3-yl)-N-(2-propan-2-yloxyethyl)ethanamine
SMILESCC(C)OCCNCCc1ccnn1C
InChIInChI=1S/C11H21N3O/c1-10(2)15-9-8-12-6-4-11-5-7-13-14(11)3/h5,7,10,12H,4,6,8-9H2,1-3H3
InChIKeyLDLROJZYFJCLPA-UHFFFAOYSA-N
XLogP0.98
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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-[2-(2-methylpyrazol-3-yl)ethylamino]ethoxy]ethanol
CID 103001295
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
4-bromo-N-[2-(2-methylpyrazol-3-yl)ethyl]butan-1-amine
CID 106844750
2-[2-(2-methylpyrazol-3-yl)ethylamino]-N-propan-2-ylacetamide
CID 103000916
N',N'-dimethyl-N-[2-(2-methylpyrazol-3-yl)ethyl]propane-1,3-diamine
CID 103000722
6-[2-(2-methylpyrazol-3-yl)ethylamino]hexan-1-ol
CID 107703692
2-(1-methylpyrazol-3-yl)-N-[2-(2-methylpyrazol-3-yl)ethyl]ethanamine
CID 114143932
N-(2-propan-2-yloxyethyl)-2-pyridin-4-ylethanamine
CID 61485275
2-[2-[2-(2-methylpyrazol-3-yl)ethylamino]ethoxy]benzoic acid
CID 103268835

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpyrazol-3-yl)-N-(2-propan-2-yloxyethyl)ethanamine?
The IUPAC name of 2-(2-methylpyrazol-3-yl)-N-(2-propan-2-yloxyethyl)ethanamine (CID 103002048) is 2-(2-methylpyrazol-3-yl)-N-(2-propan-2-yloxyethyl)ethanamine.
What is the SMILES notation for 2-(2-methylpyrazol-3-yl)-N-(2-propan-2-yloxyethyl)ethanamine?
The canonical SMILES for 2-(2-methylpyrazol-3-yl)-N-(2-propan-2-yloxyethyl)ethanamine is CC(C)OCCNCCc1ccnn1C.
What is the InChIKey of 2-(2-methylpyrazol-3-yl)-N-(2-propan-2-yloxyethyl)ethanamine?
The InChIKey is LDLROJZYFJCLPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-10(2)15-9-8-12-6-4-11-5-7-13-14(11)3/h5,7,10,12H,4,6,8-9H2,1-3H3.
What are the key properties of 2-(2-methylpyrazol-3-yl)-N-(2-propan-2-yloxyethyl)ethanamine?
2-(2-methylpyrazol-3-yl)-N-(2-propan-2-yloxyethyl)ethanamine has a molecular weight of 211.31 g/mol, XLogP of 0.98, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpyrazol-3-yl)-N-(2-propan-2-yloxyethyl)ethanamine is sourced from PubChem (CID 103002048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).