1-ethyl-3-methoxy-4-phenylpyrazol-5-amine

C12H15N3O — CID 68878542

IUPAC1-ethyl-3-methoxy-4-phenylpyrazol-5-amine
SMILESCCn1nc(OC)c(-c2ccccc2)c1N
InChIInChI=1S/C12H15N3O/c1-3-15-11(13)10(12(14-15)16-2)9-7-5-4-6-8-9/h4-8H,3,13H2,1-2H3
InChIKeyDJQXOAXSOAMRBV-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.16
Rot. Bonds3

About 1-ethyl-3-methoxy-4-phenylpyrazol-5-amine

1-ethyl-3-methoxy-4-phenylpyrazol-5-amine (PubChem CID 68878542) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is 1-ethyl-3-methoxy-4-phenylpyrazol-5-amine.

Molecular Properties

Compound Name1-ethyl-3-methoxy-4-phenylpyrazol-5-amine
PubChem CID68878542
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name1-ethyl-3-methoxy-4-phenylpyrazol-5-amine
SMILESCCn1nc(OC)c(-c2ccccc2)c1N
InChIInChI=1S/C12H15N3O/c1-3-15-11(13)10(12(14-15)16-2)9-7-5-4-6-8-9/h4-8H,3,13H2,1-2H3
InChIKeyDJQXOAXSOAMRBV-UHFFFAOYSA-N
XLogP2.16
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-4-methyl-3-phenylpyridine
CID 46315014
3-methoxy-4-phenyl-1H-pyrazol-5-amine
CID 138488838
1-benzyl-4-(4-methoxyphenyl)-3-methylpyrazol-5-amine
CID 970025
5-amino-1-ethyl-3-phenylmethoxypyrazole-4-carbonitrile
CID 100762021
1-ethyl-3,5-diphenylpyrazole
CID 12665793
1-ethyl-5-phenylpyrazol-4-amine
CID 105442691
5-tert-butyl-3-methoxy-4-phenyl-1-propan-2-ylpyrazole
CID 153441144
5-ethyl-4-methoxy-6-phenylpyrimidin-2-amine
CID 12597618
3-methoxy-5-(3-methylbutan-2-yl)-4-phenyl-1-propan-2-ylpyrazole;platinum
CID 153442122
1,3-dimethoxy-4-phenylpyrido[4,3-b]quinoxaline
CID 11120684
1-ethyl-3-methoxy-4,5-dimethylpyrazole
CID 142138593
1-ethyl-4-isocyano-3-(4-methoxyphenyl)pyrazol-5-amine
CID 158935224

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-methoxy-4-phenylpyrazol-5-amine?
The IUPAC name of 1-ethyl-3-methoxy-4-phenylpyrazol-5-amine (CID 68878542) is 1-ethyl-3-methoxy-4-phenylpyrazol-5-amine.
What is the SMILES notation for 1-ethyl-3-methoxy-4-phenylpyrazol-5-amine?
The canonical SMILES for 1-ethyl-3-methoxy-4-phenylpyrazol-5-amine is CCn1nc(OC)c(-c2ccccc2)c1N.
What is the InChIKey of 1-ethyl-3-methoxy-4-phenylpyrazol-5-amine?
The InChIKey is DJQXOAXSOAMRBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-3-15-11(13)10(12(14-15)16-2)9-7-5-4-6-8-9/h4-8H,3,13H2,1-2H3.
What are the key properties of 1-ethyl-3-methoxy-4-phenylpyrazol-5-amine?
1-ethyl-3-methoxy-4-phenylpyrazol-5-amine has a molecular weight of 217.27 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-methoxy-4-phenylpyrazol-5-amine is sourced from PubChem (CID 68878542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).