1-(aminomethyl)pyrazol-4-ol

C4H7N3O — CID 117125261

IUPAC1-(aminomethyl)pyrazol-4-ol
SMILESNCn1cc(O)cn1
InChIInChI=1S/C4H7N3O/c5-3-7-2-4(8)1-6-7/h1-2,8H,3,5H2
InChIKeyUERFMZMXPKGUIO-UHFFFAOYSA-N
MW113.12 g/mol
LogP-0.50
Rot. Bonds1

About 1-(aminomethyl)pyrazol-4-ol

1-(aminomethyl)pyrazol-4-ol (PubChem CID 117125261) has the molecular formula C4H7N3O and a molecular weight of 113.12 g/mol. Its IUPAC name is 1-(aminomethyl)pyrazol-4-ol.

Molecular Properties

Compound Name1-(aminomethyl)pyrazol-4-ol
PubChem CID117125261
Molecular FormulaC4H7N3O
Molecular Weight113.12 g/mol
Exact Mass113.06
IUPAC Name1-(aminomethyl)pyrazol-4-ol
SMILESNCn1cc(O)cn1
InChIInChI=1S/C4H7N3O/c5-3-7-2-4(8)1-6-7/h1-2,8H,3,5H2
InChIKeyUERFMZMXPKGUIO-UHFFFAOYSA-N
XLogP-0.50
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.12
LogP ≤ 5-0.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-fluoropropyl)pyrazol-4-ol
CID 116799422
1-[(2-hydroxyphenyl)methyl]pyrazol-4-ol
CID 117124791
1-[(1-aminocyclopropyl)methyl]pyrazol-4-ol
CID 84763385
1-(2-methoxyethyl)pyrazol-4-ol
CID 75466201
1-but-2-ynylpyrazol-4-ol
CID 122240485
3-[1-(aminomethyl)pyrazol-4-yl]oxyphenol
CID 117125233
1-(2-phenylsulfanylethyl)pyrazol-4-ol
CID 116799458
1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-ol
CID 116799436
1-(4-methylpentyl)pyrazol-4-ol
CID 116799439
1-(2-trimethylsilylethoxymethyl)pyrazol-4-ol
CID 90030095
1-[2-(trifluoromethylsulfanyl)ethyl]pyrazol-4-ol
CID 116799456
1-(3-ethylsulfanylpropyl)pyrazol-4-ol
CID 116799350

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)pyrazol-4-ol?
The IUPAC name of 1-(aminomethyl)pyrazol-4-ol (CID 117125261) is 1-(aminomethyl)pyrazol-4-ol.
What is the SMILES notation for 1-(aminomethyl)pyrazol-4-ol?
The canonical SMILES for 1-(aminomethyl)pyrazol-4-ol is NCn1cc(O)cn1.
What is the InChIKey of 1-(aminomethyl)pyrazol-4-ol?
The InChIKey is UERFMZMXPKGUIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7N3O/c5-3-7-2-4(8)1-6-7/h1-2,8H,3,5H2.
What are the key properties of 1-(aminomethyl)pyrazol-4-ol?
1-(aminomethyl)pyrazol-4-ol has a molecular weight of 113.12 g/mol, XLogP of -0.50, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)pyrazol-4-ol is sourced from PubChem (CID 117125261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).