5-methyl-4-phenyl-1H-pyrazol-3-amine

C10H11N3 — CID 599501

IUPAC5-methyl-4-phenyl-1H-pyrazol-3-amine
SMILESCc1[nH]nc(N)c1-c1ccccc1
InChIInChI=1S/C10H11N3/c1-7-9(10(11)13-12-7)8-5-3-2-4-6-8/h2-6H,1H3,(H3,11,12,13)
InChIKeyUMDNRKCXSUJMCY-UHFFFAOYSA-N
MW173.22 g/mol
LogP1.97
Rot. Bonds1

About 5-methyl-4-phenyl-1H-pyrazol-3-amine

5-methyl-4-phenyl-1H-pyrazol-3-amine (PubChem CID 599501) has the molecular formula C10H11N3 and a molecular weight of 173.22 g/mol. Its IUPAC name is 5-methyl-4-phenyl-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-methyl-4-phenyl-1H-pyrazol-3-amine
PubChem CID599501
Molecular FormulaC10H11N3
Molecular Weight173.22 g/mol
Exact Mass173.10
IUPAC Name5-methyl-4-phenyl-1H-pyrazol-3-amine
SMILESCc1[nH]nc(N)c1-c1ccccc1
InChIInChI=1S/C10H11N3/c1-7-9(10(11)13-12-7)8-5-3-2-4-6-8/h2-6H,1H3,(H3,11,12,13)
InChIKeyUMDNRKCXSUJMCY-UHFFFAOYSA-N
XLogP1.97
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-4-phenyl-1H-pyrazol-3-amine?
The IUPAC name of 5-methyl-4-phenyl-1H-pyrazol-3-amine (CID 599501) is 5-methyl-4-phenyl-1H-pyrazol-3-amine.
What is the SMILES notation for 5-methyl-4-phenyl-1H-pyrazol-3-amine?
The canonical SMILES for 5-methyl-4-phenyl-1H-pyrazol-3-amine is Cc1[nH]nc(N)c1-c1ccccc1.
What is the InChIKey of 5-methyl-4-phenyl-1H-pyrazol-3-amine?
The InChIKey is UMDNRKCXSUJMCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3/c1-7-9(10(11)13-12-7)8-5-3-2-4-6-8/h2-6H,1H3,(H3,11,12,13).
What are the key properties of 5-methyl-4-phenyl-1H-pyrazol-3-amine?
5-methyl-4-phenyl-1H-pyrazol-3-amine has a molecular weight of 173.22 g/mol, XLogP of 1.97, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-4-phenyl-1H-pyrazol-3-amine is sourced from PubChem (CID 599501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).