1-amino-2-(2-phenylpyrazol-3-yl)propan-2-ol

C12H15N3O — CID 107329988

IUPAC1-amino-2-(2-phenylpyrazol-3-yl)propan-2-ol
SMILESCC(O)(CN)c1ccnn1-c1ccccc1
InChIInChI=1S/C12H15N3O/c1-12(16,9-13)11-7-8-14-15(11)10-5-3-2-4-6-10/h2-8,16H,9,13H2,1H3
InChIKeyAKJWPKUHLQAULG-UHFFFAOYSA-N
MW217.27 g/mol
LogP1.04
Rot. Bonds3

About 1-amino-2-(2-phenylpyrazol-3-yl)propan-2-ol

1-amino-2-(2-phenylpyrazol-3-yl)propan-2-ol (PubChem CID 107329988) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is 1-amino-2-(2-phenylpyrazol-3-yl)propan-2-ol.

Molecular Properties

Compound Name1-amino-2-(2-phenylpyrazol-3-yl)propan-2-ol
PubChem CID107329988
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name1-amino-2-(2-phenylpyrazol-3-yl)propan-2-ol
SMILESCC(O)(CN)c1ccnn1-c1ccccc1
InChIInChI=1S/C12H15N3O/c1-12(16,9-13)11-7-8-14-15(11)10-5-3-2-4-6-10/h2-8,16H,9,13H2,1H3
InChIKeyAKJWPKUHLQAULG-UHFFFAOYSA-N
XLogP1.04
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-ethoxy-2-(2-phenylpyrazol-3-yl)propan-2-ol
CID 107330025
1-(cyclopropylamino)-2-(2-phenylpyrazol-3-yl)propan-2-ol
CID 107331455
1-amino-2-(2-methylpyrazol-3-yl)propan-2-ol
CID 66039354
2,6-dimethyl-4-(2-phenylpyrazol-3-yl)heptan-4-ol
CID 107330039
1-(4-methylphenyl)-1-(2-phenylpyrazol-3-yl)ethanol
CID 107329790
1-(2-phenylpyrazol-3-yl)-1-thiophen-2-ylethanol
CID 107329817
5-(2,2-dimethylpropyl)-1-phenylpyrazole
CID 58161963
N-ethyl-4-methyl-4-(2-phenylpyrazol-3-yl)pentan-2-amine
CID 107331269
3-methyl-3-(2-phenylpyrazol-3-yl)-N-propylbutan-1-amine
CID 107331523
2-(aminomethyl)-2-ethyl-1-(2-phenylpyrazol-3-yl)butan-1-one
CID 107331719
2-(2-phenylpyrazol-3-yl)propan-1-amine
CID 105453704
1-amino-2-phenylpropan-2-ol;hydrochloride
CID 17039439

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-(2-phenylpyrazol-3-yl)propan-2-ol?
The IUPAC name of 1-amino-2-(2-phenylpyrazol-3-yl)propan-2-ol (CID 107329988) is 1-amino-2-(2-phenylpyrazol-3-yl)propan-2-ol.
What is the SMILES notation for 1-amino-2-(2-phenylpyrazol-3-yl)propan-2-ol?
The canonical SMILES for 1-amino-2-(2-phenylpyrazol-3-yl)propan-2-ol is CC(O)(CN)c1ccnn1-c1ccccc1.
What is the InChIKey of 1-amino-2-(2-phenylpyrazol-3-yl)propan-2-ol?
The InChIKey is AKJWPKUHLQAULG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-12(16,9-13)11-7-8-14-15(11)10-5-3-2-4-6-10/h2-8,16H,9,13H2,1H3.
What are the key properties of 1-amino-2-(2-phenylpyrazol-3-yl)propan-2-ol?
1-amino-2-(2-phenylpyrazol-3-yl)propan-2-ol has a molecular weight of 217.27 g/mol, XLogP of 1.04, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-(2-phenylpyrazol-3-yl)propan-2-ol is sourced from PubChem (CID 107329988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).