2-amino-1-(1-ethylpyrazol-4-yl)ethanol

C7H13N3O — CID 55264385

IUPAC2-amino-1-(1-ethylpyrazol-4-yl)ethanol
SMILESCCn1cc(C(O)CN)cn1
InChIInChI=1S/C7H13N3O/c1-2-10-5-6(4-9-10)7(11)3-8/h4-5,7,11H,2-3,8H2,1H3
InChIKeySBDVCNXINPNTRT-UHFFFAOYSA-N
MW155.20 g/mol
LogP-0.10
Rot. Bonds3

About 2-amino-1-(1-ethylpyrazol-4-yl)ethanol

2-amino-1-(1-ethylpyrazol-4-yl)ethanol (PubChem CID 55264385) has the molecular formula C7H13N3O and a molecular weight of 155.20 g/mol. Its IUPAC name is 2-amino-1-(1-ethylpyrazol-4-yl)ethanol.

Molecular Properties

Compound Name2-amino-1-(1-ethylpyrazol-4-yl)ethanol
PubChem CID55264385
Molecular FormulaC7H13N3O
Molecular Weight155.20 g/mol
Exact Mass155.11
IUPAC Name2-amino-1-(1-ethylpyrazol-4-yl)ethanol
SMILESCCn1cc(C(O)CN)cn1
InChIInChI=1S/C7H13N3O/c1-2-10-5-6(4-9-10)7(11)3-8/h4-5,7,11H,2-3,8H2,1H3
InChIKeySBDVCNXINPNTRT-UHFFFAOYSA-N
XLogP-0.10
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 5-0.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-1-[1-(2-methylpropyl)pyrazol-4-yl]ethanol
CID 82407041
N-ethyl-1-(1-ethylpyrazol-4-yl)-N-methylethane-1,2-diamine
CID 103569436
1-(1-ethylpyrazol-4-yl)propane-1,2-diol
CID 103452757
1-(1-ethylpyrazol-4-yl)dodecan-1-ol
CID 115778864
2-amino-1-(1-ethylpyrazol-4-yl)butan-1-ol
CID 103570009
2-ethyl-1-(1-ethylpyrazol-4-yl)butan-1-ol
CID 63894691
1-(1-ethylpyrazol-4-yl)-2-methylsulfonylethanol
CID 115601039
3-(1-ethylpyrazol-4-yl)butan-1-amine
CID 81014220
2-amino-1-(1-tert-butylpyrazol-4-yl)ethanol
CID 84732544
1-(1-ethylpyrazol-4-yl)-2-(4-methylphenyl)ethanol
CID 55061914
N-[2-(1-ethylpyrazol-4-yl)-2-hydroxyethyl]acetamide
CID 157036975
2-ethyl-1-(1-ethylpyrazol-4-yl)butane-1,2-diol
CID 103449416

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(1-ethylpyrazol-4-yl)ethanol?
The IUPAC name of 2-amino-1-(1-ethylpyrazol-4-yl)ethanol (CID 55264385) is 2-amino-1-(1-ethylpyrazol-4-yl)ethanol.
What is the SMILES notation for 2-amino-1-(1-ethylpyrazol-4-yl)ethanol?
The canonical SMILES for 2-amino-1-(1-ethylpyrazol-4-yl)ethanol is CCn1cc(C(O)CN)cn1.
What is the InChIKey of 2-amino-1-(1-ethylpyrazol-4-yl)ethanol?
The InChIKey is SBDVCNXINPNTRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O/c1-2-10-5-6(4-9-10)7(11)3-8/h4-5,7,11H,2-3,8H2,1H3.
What are the key properties of 2-amino-1-(1-ethylpyrazol-4-yl)ethanol?
2-amino-1-(1-ethylpyrazol-4-yl)ethanol has a molecular weight of 155.20 g/mol, XLogP of -0.10, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(1-ethylpyrazol-4-yl)ethanol is sourced from PubChem (CID 55264385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).