4-(4-ethyl-3-methylphenyl)-1-methylpyrazol-5-amine

C13H17N3 — CID 117307110

IUPAC4-(4-ethyl-3-methylphenyl)-1-methylpyrazol-5-amine
SMILESCCc1ccc(-c2cnn(C)c2N)cc1C
InChIInChI=1S/C13H17N3/c1-4-10-5-6-11(7-9(10)2)12-8-15-16(3)13(12)14/h5-8H,4,14H2,1-3H3
InChIKeyKCGBNZDPCQCOCQ-UHFFFAOYSA-N
MW215.30 g/mol
LogP2.54
Rot. Bonds2

About 4-(4-ethyl-3-methylphenyl)-1-methylpyrazol-5-amine

4-(4-ethyl-3-methylphenyl)-1-methylpyrazol-5-amine (PubChem CID 117307110) has the molecular formula C13H17N3 and a molecular weight of 215.30 g/mol. Its IUPAC name is 4-(4-ethyl-3-methylphenyl)-1-methylpyrazol-5-amine.

Molecular Properties

Compound Name4-(4-ethyl-3-methylphenyl)-1-methylpyrazol-5-amine
PubChem CID117307110
Molecular FormulaC13H17N3
Molecular Weight215.30 g/mol
Exact Mass215.14
IUPAC Name4-(4-ethyl-3-methylphenyl)-1-methylpyrazol-5-amine
SMILESCCc1ccc(-c2cnn(C)c2N)cc1C
InChIInChI=1S/C13H17N3/c1-4-10-5-6-11(7-9(10)2)12-8-15-16(3)13(12)14/h5-8H,4,14H2,1-3H3
InChIKeyKCGBNZDPCQCOCQ-UHFFFAOYSA-N
XLogP2.54
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3,4-dimethylphenyl)-1-methylpyrazol-5-amine
CID 62901487
4-(2-ethyl-1,3-benzothiazol-6-yl)-1-methylpyrazol-5-amine
CID 117399664
4-(5-amino-1-methylpyrazol-4-yl)-2-ethyl-5-methylphenol
CID 117334699
4-(5-ethyl-4-fluoro-2-methylphenyl)-1-methylpyrazol-5-amine
CID 117338339
4-(3-fluoro-4-pentan-3-ylphenyl)-1-methylpyrazol-5-amine
CID 117407893
4-ethyl-1-methylpyrazol-5-amine
CID 22456644
4-(5-ethyl-2,3-dimethylphenyl)-1-methylpyrazol-5-amine
CID 117331158
4-(4-bromo-3-fluorophenyl)-1-methylpyrazol-5-amine
CID 117428222
4-(9-ethylcarbazol-3-yl)-1-methylpyrazol-5-amine
CID 117469258
4-(2,3-dimethyl-1-benzothiophen-6-yl)-1-methylpyrazol-5-amine
CID 117397140
4-(5-amino-1-methylpyrazol-4-yl)-2-bromo-6-methylphenol
CID 117453163
4-[3-(dimethylamino)-4-fluorophenyl]-1-methylpyrazol-5-amine
CID 115112491

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethyl-3-methylphenyl)-1-methylpyrazol-5-amine?
The IUPAC name of 4-(4-ethyl-3-methylphenyl)-1-methylpyrazol-5-amine (CID 117307110) is 4-(4-ethyl-3-methylphenyl)-1-methylpyrazol-5-amine.
What is the SMILES notation for 4-(4-ethyl-3-methylphenyl)-1-methylpyrazol-5-amine?
The canonical SMILES for 4-(4-ethyl-3-methylphenyl)-1-methylpyrazol-5-amine is CCc1ccc(-c2cnn(C)c2N)cc1C.
What is the InChIKey of 4-(4-ethyl-3-methylphenyl)-1-methylpyrazol-5-amine?
The InChIKey is KCGBNZDPCQCOCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3/c1-4-10-5-6-11(7-9(10)2)12-8-15-16(3)13(12)14/h5-8H,4,14H2,1-3H3.
What are the key properties of 4-(4-ethyl-3-methylphenyl)-1-methylpyrazol-5-amine?
4-(4-ethyl-3-methylphenyl)-1-methylpyrazol-5-amine has a molecular weight of 215.30 g/mol, XLogP of 2.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethyl-3-methylphenyl)-1-methylpyrazol-5-amine is sourced from PubChem (CID 117307110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).