1-(2-methoxyethoxyamino)-3-pyrazol-1-ylpropan-2-ol

C9H17N3O3 — CID 82722523

IUPAC1-(2-methoxyethoxyamino)-3-pyrazol-1-ylpropan-2-ol
SMILESCOCCONCC(O)Cn1cccn1
InChIInChI=1S/C9H17N3O3/c1-14-5-6-15-11-7-9(13)8-12-4-2-3-10-12/h2-4,9,11,13H,5-8H2,1H3
InChIKeyIFATZIGCJRZIGS-UHFFFAOYSA-N
MW215.25 g/mol
LogP-0.59
Rot. Bonds8

About 1-(2-methoxyethoxyamino)-3-pyrazol-1-ylpropan-2-ol

1-(2-methoxyethoxyamino)-3-pyrazol-1-ylpropan-2-ol (PubChem CID 82722523) has the molecular formula C9H17N3O3 and a molecular weight of 215.25 g/mol. Its IUPAC name is 1-(2-methoxyethoxyamino)-3-pyrazol-1-ylpropan-2-ol.

Molecular Properties

Compound Name1-(2-methoxyethoxyamino)-3-pyrazol-1-ylpropan-2-ol
PubChem CID82722523
Molecular FormulaC9H17N3O3
Molecular Weight215.25 g/mol
Exact Mass215.13
IUPAC Name1-(2-methoxyethoxyamino)-3-pyrazol-1-ylpropan-2-ol
SMILESCOCCONCC(O)Cn1cccn1
InChIInChI=1S/C9H17N3O3/c1-14-5-6-15-11-7-9(13)8-12-4-2-3-10-12/h2-4,9,11,13H,5-8H2,1H3
InChIKeyIFATZIGCJRZIGS-UHFFFAOYSA-N
XLogP-0.59
TPSA68.54 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 5-0.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

(2R)-1-methoxy-3-pyrazol-1-ylpropan-2-ol
CID 131206814
1-(phenylmethoxyamino)-3-pyrazol-1-ylpropan-2-ol
CID 64974574
methyl 2-[(2-hydroxy-3-pyrazol-1-ylpropyl)amino]propanoate
CID 61499693
1-(2-methylpropylamino)-3-pyrazol-1-ylpropan-2-ol
CID 60904302
1-(3-methylbutylamino)-3-pyrazol-1-ylpropan-2-ol
CID 60897907
N-ethyl-2-[(2-hydroxy-3-pyrazol-1-ylpropyl)amino]acetamide
CID 60910442
1-[[1-(hydroxymethyl)cyclopentyl]amino]-3-pyrazol-1-ylpropan-2-ol
CID 55082435
1-(2,4-dimethoxyanilino)-3-pyrazol-1-ylpropan-2-ol
CID 60898605
1-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]-3-pyrazol-1-ylpropan-2-ol
CID 81371484
methyl (2R)-2-methyl-3-pyrazol-1-ylpropanoate
CID 42574632
(2S)-1-methoxy-4-pyrazol-1-ylbutan-2-ol
CID 134462752
1-(pent-1-yn-3-ylamino)-3-pyrazol-1-ylpropan-2-ol
CID 106229335

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethoxyamino)-3-pyrazol-1-ylpropan-2-ol?
The IUPAC name of 1-(2-methoxyethoxyamino)-3-pyrazol-1-ylpropan-2-ol (CID 82722523) is 1-(2-methoxyethoxyamino)-3-pyrazol-1-ylpropan-2-ol.
What is the SMILES notation for 1-(2-methoxyethoxyamino)-3-pyrazol-1-ylpropan-2-ol?
The canonical SMILES for 1-(2-methoxyethoxyamino)-3-pyrazol-1-ylpropan-2-ol is COCCONCC(O)Cn1cccn1.
What is the InChIKey of 1-(2-methoxyethoxyamino)-3-pyrazol-1-ylpropan-2-ol?
The InChIKey is IFATZIGCJRZIGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O3/c1-14-5-6-15-11-7-9(13)8-12-4-2-3-10-12/h2-4,9,11,13H,5-8H2,1H3.
What are the key properties of 1-(2-methoxyethoxyamino)-3-pyrazol-1-ylpropan-2-ol?
1-(2-methoxyethoxyamino)-3-pyrazol-1-ylpropan-2-ol has a molecular weight of 215.25 g/mol, XLogP of -0.59, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethoxyamino)-3-pyrazol-1-ylpropan-2-ol is sourced from PubChem (CID 82722523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).