2-amino-1-(3-ethyl-1-methylpyrazol-4-yl)ethanol

C8H15N3O — CID 130166119

IUPAC2-amino-1-(3-ethyl-1-methylpyrazol-4-yl)ethanol
SMILESCCc1nn(C)cc1C(O)CN
InChIInChI=1S/C8H15N3O/c1-3-7-6(8(12)4-9)5-11(2)10-7/h5,8,12H,3-4,9H2,1-2H3
InChIKeyGXFYWBPMUPIJAH-UHFFFAOYSA-N
MW169.23 g/mol
LogP-0.03
Rot. Bonds3

About 2-amino-1-(3-ethyl-1-methylpyrazol-4-yl)ethanol

2-amino-1-(3-ethyl-1-methylpyrazol-4-yl)ethanol (PubChem CID 130166119) has the molecular formula C8H15N3O and a molecular weight of 169.23 g/mol. Its IUPAC name is 2-amino-1-(3-ethyl-1-methylpyrazol-4-yl)ethanol.

Molecular Properties

Compound Name2-amino-1-(3-ethyl-1-methylpyrazol-4-yl)ethanol
PubChem CID130166119
Molecular FormulaC8H15N3O
Molecular Weight169.23 g/mol
Exact Mass169.12
IUPAC Name2-amino-1-(3-ethyl-1-methylpyrazol-4-yl)ethanol
SMILESCCc1nn(C)cc1C(O)CN
InChIInChI=1S/C8H15N3O/c1-3-7-6(8(12)4-9)5-11(2)10-7/h5,8,12H,3-4,9H2,1-2H3
InChIKeyGXFYWBPMUPIJAH-UHFFFAOYSA-N
XLogP-0.03
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.23
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-ethyl-1-methylpyrazol-4-yl)-N,N-dimethylethane-1,2-diamine
CID 112669221
(1R)-2-amino-1-(1,3-dimethylpyrazol-4-yl)ethanol
CID 83000950
2-(4-tert-butylphenyl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethanol
CID 115990490
1-(3-ethyl-1-methylpyrazol-4-yl)-2-(2,4,6-trimethylphenyl)ethanol
CID 115990545
propyl 4-(3-ethyl-1-methylpyrazol-4-yl)-4-hydroxybutanoate
CID 112670847
[1-(aminomethyl)cyclopentyl]-(3-ethyl-1-methylpyrazol-4-yl)methanol
CID 112671560
2-(3,4-dichlorophenyl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethanol
CID 112670375
4-(difluoromethyl)-3-ethyl-1-methylpyrazole;ethane
CID 165139530
1-(3-ethyl-1-methylpyrazol-4-yl)-N-(2-methylprop-2-enyl)ethane-1,2-diamine
CID 114616015
3-[[2-amino-1-(3-ethyl-1-methylpyrazol-4-yl)ethyl]amino]propan-1-ol
CID 112669542
2-(azocan-1-yl)-2-(3-ethyl-1-methylpyrazol-4-yl)ethanamine
CID 112669237
1-(3-ethyl-1-methylpyrazol-4-yl)-3-(2-methylpyrazol-3-yl)propan-1-ol
CID 103006766

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(3-ethyl-1-methylpyrazol-4-yl)ethanol?
The IUPAC name of 2-amino-1-(3-ethyl-1-methylpyrazol-4-yl)ethanol (CID 130166119) is 2-amino-1-(3-ethyl-1-methylpyrazol-4-yl)ethanol.
What is the SMILES notation for 2-amino-1-(3-ethyl-1-methylpyrazol-4-yl)ethanol?
The canonical SMILES for 2-amino-1-(3-ethyl-1-methylpyrazol-4-yl)ethanol is CCc1nn(C)cc1C(O)CN.
What is the InChIKey of 2-amino-1-(3-ethyl-1-methylpyrazol-4-yl)ethanol?
The InChIKey is GXFYWBPMUPIJAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O/c1-3-7-6(8(12)4-9)5-11(2)10-7/h5,8,12H,3-4,9H2,1-2H3.
What are the key properties of 2-amino-1-(3-ethyl-1-methylpyrazol-4-yl)ethanol?
2-amino-1-(3-ethyl-1-methylpyrazol-4-yl)ethanol has a molecular weight of 169.23 g/mol, XLogP of -0.03, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(3-ethyl-1-methylpyrazol-4-yl)ethanol is sourced from PubChem (CID 130166119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).