4-methyl-1-(2-phenylethyl)pyrazol-5-amine

C12H15N3 — CID 43148141

IUPAC4-methyl-1-(2-phenylethyl)pyrazol-5-amine
SMILESCc1cnn(CCc2ccccc2)c1N
InChIInChI=1S/C12H15N3/c1-10-9-14-15(12(10)13)8-7-11-5-3-2-4-6-11/h2-6,9H,7-8,13H2,1H3
InChIKeyQQSAALMYPDYVHU-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.02
Rot. Bonds3

About 4-methyl-1-(2-phenylethyl)pyrazol-5-amine

4-methyl-1-(2-phenylethyl)pyrazol-5-amine (PubChem CID 43148141) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 4-methyl-1-(2-phenylethyl)pyrazol-5-amine.

Molecular Properties

Compound Name4-methyl-1-(2-phenylethyl)pyrazol-5-amine
PubChem CID43148141
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC Name4-methyl-1-(2-phenylethyl)pyrazol-5-amine
SMILESCc1cnn(CCc2ccccc2)c1N
InChIInChI=1S/C12H15N3/c1-10-9-14-15(12(10)13)8-7-11-5-3-2-4-6-11/h2-6,9H,7-8,13H2,1H3
InChIKeyQQSAALMYPDYVHU-UHFFFAOYSA-N
XLogP2.02
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(2-phenylethyl)pyrazol-5-amine?
The IUPAC name of 4-methyl-1-(2-phenylethyl)pyrazol-5-amine (CID 43148141) is 4-methyl-1-(2-phenylethyl)pyrazol-5-amine.
What is the SMILES notation for 4-methyl-1-(2-phenylethyl)pyrazol-5-amine?
The canonical SMILES for 4-methyl-1-(2-phenylethyl)pyrazol-5-amine is Cc1cnn(CCc2ccccc2)c1N.
What is the InChIKey of 4-methyl-1-(2-phenylethyl)pyrazol-5-amine?
The InChIKey is QQSAALMYPDYVHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-10-9-14-15(12(10)13)8-7-11-5-3-2-4-6-11/h2-6,9H,7-8,13H2,1H3.
What are the key properties of 4-methyl-1-(2-phenylethyl)pyrazol-5-amine?
4-methyl-1-(2-phenylethyl)pyrazol-5-amine has a molecular weight of 201.27 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(2-phenylethyl)pyrazol-5-amine is sourced from PubChem (CID 43148141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).