3-[1-(aminomethyl)pyrazol-4-yl]oxyphenol

C10H11N3O2 — CID 117125233

IUPAC3-[1-(aminomethyl)pyrazol-4-yl]oxyphenol
SMILESNCn1cc(Oc2cccc(O)c2)cn1
InChIInChI=1S/C10H11N3O2/c11-7-13-6-10(5-12-13)15-9-3-1-2-8(14)4-9/h1-6,14H,7,11H2
InChIKeyGFBSJJXWZSOKNI-UHFFFAOYSA-N
MW205.22 g/mol
LogP1.30
Rot. Bonds3

About 3-[1-(aminomethyl)pyrazol-4-yl]oxyphenol

3-[1-(aminomethyl)pyrazol-4-yl]oxyphenol (PubChem CID 117125233) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is 3-[1-(aminomethyl)pyrazol-4-yl]oxyphenol.

Molecular Properties

Compound Name3-[1-(aminomethyl)pyrazol-4-yl]oxyphenol
PubChem CID117125233
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Name3-[1-(aminomethyl)pyrazol-4-yl]oxyphenol
SMILESNCn1cc(Oc2cccc(O)c2)cn1
InChIInChI=1S/C10H11N3O2/c11-7-13-6-10(5-12-13)15-9-3-1-2-8(14)4-9/h1-6,14H,7,11H2
InChIKeyGFBSJJXWZSOKNI-UHFFFAOYSA-N
XLogP1.30
TPSA73.30 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[1-(2-hydroxypropyl)pyrazol-4-yl]oxyphenol
CID 117124853
3-[1-[2-(methylamino)ethyl]pyrazol-4-yl]oxyphenol
CID 117125332
3-(1-tert-butylpyrazol-4-yl)oxyphenol
CID 117229457
2-[4-(3-hydroxyphenoxy)pyrazol-1-yl]phenol
CID 117229367
3-[1-(4-chlorophenyl)pyrazol-4-yl]oxyphenol
CID 117229418
3-[4-(3-chlorophenoxy)pyrazol-1-yl]propan-1-amine
CID 115055461
3-[1-(3-fluorophenyl)pyrazol-4-yl]oxyphenol
CID 117229390
3-[2-(2-aminoethyl)pyrimidin-5-yl]oxyphenol
CID 115038185
1-(aminomethyl)pyrazol-4-ol
CID 117125261
1-[4-(3-bromophenoxy)pyrazol-1-yl]propan-2-amine
CID 117125328
3-[4-(3-methoxyphenoxy)pyrazol-1-yl]propanoic acid
CID 115055488
3-[4-[[4-(3-hydroxyphenoxy)phenyl]methyl]phenoxy]phenol
CID 153483727

Frequently Asked Questions

What is the IUPAC name of 3-[1-(aminomethyl)pyrazol-4-yl]oxyphenol?
The IUPAC name of 3-[1-(aminomethyl)pyrazol-4-yl]oxyphenol (CID 117125233) is 3-[1-(aminomethyl)pyrazol-4-yl]oxyphenol.
What is the SMILES notation for 3-[1-(aminomethyl)pyrazol-4-yl]oxyphenol?
The canonical SMILES for 3-[1-(aminomethyl)pyrazol-4-yl]oxyphenol is NCn1cc(Oc2cccc(O)c2)cn1.
What is the InChIKey of 3-[1-(aminomethyl)pyrazol-4-yl]oxyphenol?
The InChIKey is GFBSJJXWZSOKNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c11-7-13-6-10(5-12-13)15-9-3-1-2-8(14)4-9/h1-6,14H,7,11H2.
What are the key properties of 3-[1-(aminomethyl)pyrazol-4-yl]oxyphenol?
3-[1-(aminomethyl)pyrazol-4-yl]oxyphenol has a molecular weight of 205.22 g/mol, XLogP of 1.30, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(aminomethyl)pyrazol-4-yl]oxyphenol is sourced from PubChem (CID 117125233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).