1-(3-amino-4,5-dihydro-1H-pyrazol-4-yl)ethanol

C5H11N3O — CID 11007925

IUPAC1-(3-amino-4,5-dihydro-1H-pyrazol-4-yl)ethanol
SMILESCC(O)C1CNN=C1N
InChIInChI=1S/C5H11N3O/c1-3(9)4-2-7-8-5(4)6/h3-4,7,9H,2H2,1H3,(H2,6,8)
InChIKeyDCAUJGRVUSKYTL-UHFFFAOYSA-N
MW129.16 g/mol
LogP-1.14
Rot. Bonds1

About 1-(3-amino-4,5-dihydro-1H-pyrazol-4-yl)ethanol

1-(3-amino-4,5-dihydro-1H-pyrazol-4-yl)ethanol (PubChem CID 11007925) has the molecular formula C5H11N3O and a molecular weight of 129.16 g/mol. Its IUPAC name is 1-(3-amino-4,5-dihydro-1H-pyrazol-4-yl)ethanol.

Molecular Properties

Compound Name1-(3-amino-4,5-dihydro-1H-pyrazol-4-yl)ethanol
PubChem CID11007925
Molecular FormulaC5H11N3O
Molecular Weight129.16 g/mol
Exact Mass129.09
IUPAC Name1-(3-amino-4,5-dihydro-1H-pyrazol-4-yl)ethanol
SMILESCC(O)C1CNN=C1N
InChIInChI=1S/C5H11N3O/c1-3(9)4-2-7-8-5(4)6/h3-4,7,9H,2H2,1H3,(H2,6,8)
InChIKeyDCAUJGRVUSKYTL-UHFFFAOYSA-N
XLogP-1.14
TPSA70.64 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 5-1.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-4,5-dihydro-1H-pyrazole-4-carboxylic acid
CID 54470223
(3R)-3-(1-hydroxyethyl)azetidin-2-one
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1-(azetidin-3-yl)ethanol;hydrochloride
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3-(1-hydroxyethyl)pyrrolidin-2-one
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3-[(1S)-1-hydroxyethyl]bicyclo[3.2.1]octan-2-one
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1-(4-bromo-2,3-dihydro-1H-indol-3-yl)ethanol
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1-(3,7-diazabicyclo[3.3.1]nonan-3-yl)ethanol
CID 141032628
1-(4-phenylpyrrolidin-3-yl)ethanol
CID 23009402
1-[1-[(2-methyltetrazol-5-yl)methyl]piperidin-4-yl]ethanol
CID 107052605
(1S)-1-[(5R)-1-(6-amino-4-methoxy-3-pyridinyl)-1,4-diazepan-5-yl]ethanol
CID 170272183
(1S)-1-(azetidin-3-yl)ethanamine
CID 96955547
2-[azetidin-3-yl(methyl)amino]propanamide
CID 66188290

Frequently Asked Questions

What is the IUPAC name of 1-(3-amino-4,5-dihydro-1H-pyrazol-4-yl)ethanol?
The IUPAC name of 1-(3-amino-4,5-dihydro-1H-pyrazol-4-yl)ethanol (CID 11007925) is 1-(3-amino-4,5-dihydro-1H-pyrazol-4-yl)ethanol.
What is the SMILES notation for 1-(3-amino-4,5-dihydro-1H-pyrazol-4-yl)ethanol?
The canonical SMILES for 1-(3-amino-4,5-dihydro-1H-pyrazol-4-yl)ethanol is CC(O)C1CNN=C1N.
What is the InChIKey of 1-(3-amino-4,5-dihydro-1H-pyrazol-4-yl)ethanol?
The InChIKey is DCAUJGRVUSKYTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N3O/c1-3(9)4-2-7-8-5(4)6/h3-4,7,9H,2H2,1H3,(H2,6,8).
What are the key properties of 1-(3-amino-4,5-dihydro-1H-pyrazol-4-yl)ethanol?
1-(3-amino-4,5-dihydro-1H-pyrazol-4-yl)ethanol has a molecular weight of 129.16 g/mol, XLogP of -1.14, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-amino-4,5-dihydro-1H-pyrazol-4-yl)ethanol is sourced from PubChem (CID 11007925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).