5-(2,3-dimethylphenyl)-4-ethyl-1H-pyrazol-3-amine

C13H17N3 — CID 43670611

IUPAC5-(2,3-dimethylphenyl)-4-ethyl-1H-pyrazol-3-amine
SMILESCCc1c(N)n[nH]c1-c1cccc(C)c1C
InChIInChI=1S/C13H17N3/c1-4-10-12(15-16-13(10)14)11-7-5-6-8(2)9(11)3/h5-7H,4H2,1-3H3,(H3,14,15,16)
InChIKeyZWCUVGXNXYHKPO-UHFFFAOYSA-N
MW215.30 g/mol
LogP2.84
Rot. Bonds2

About 5-(2,3-dimethylphenyl)-4-ethyl-1H-pyrazol-3-amine

5-(2,3-dimethylphenyl)-4-ethyl-1H-pyrazol-3-amine (PubChem CID 43670611) has the molecular formula C13H17N3 and a molecular weight of 215.30 g/mol. Its IUPAC name is 5-(2,3-dimethylphenyl)-4-ethyl-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(2,3-dimethylphenyl)-4-ethyl-1H-pyrazol-3-amine
PubChem CID43670611
Molecular FormulaC13H17N3
Molecular Weight215.30 g/mol
Exact Mass215.14
IUPAC Name5-(2,3-dimethylphenyl)-4-ethyl-1H-pyrazol-3-amine
SMILESCCc1c(N)n[nH]c1-c1cccc(C)c1C
InChIInChI=1S/C13H17N3/c1-4-10-12(15-16-13(10)14)11-7-5-6-8(2)9(11)3/h5-7H,4H2,1-3H3,(H3,14,15,16)
InChIKeyZWCUVGXNXYHKPO-UHFFFAOYSA-N
XLogP2.84
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-(2,3-dichlorophenyl)-4-ethyl-1H-pyrazol-3-amine
CID 43670697
5-(2,3-dimethylphenyl)-4-(3-methylphenyl)-1H-pyrazol-3-amine
CID 62830116
3-(2,3-dimethylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 24905255
5-(2-fluoro-3-methylphenyl)-4-methyl-1H-pyrazol-3-amine
CID 81477955
4-ethyl-5-(2-methyl-5-nitrophenyl)-1H-pyrazol-3-amine
CID 61292087
5-(2,4-dibromophenyl)-4-ethyl-1H-pyrazol-3-amine
CID 107955144
4-ethyl-5-(4-fluoro-3-methylphenyl)-1H-pyrazol-3-amine
CID 63210316
5-(4-methylthiophen-3-yl)-4-propyl-1H-pyrazol-3-amine
CID 79803024
5-(2-bromo-4-methoxyphenyl)-4-ethyl-1H-pyrazol-3-amine
CID 91756346
3-(2,3-dimethylphenyl)-4-ethyl-1-methylpyrazol-5-amine
CID 43670733
4-iodo-5-(2-methylphenyl)-1H-pyrazol-3-amine
CID 3812694
4-ethyl-5-methyl-1H-pyrazol-3-amine
CID 3159689

Frequently Asked Questions

What is the IUPAC name of 5-(2,3-dimethylphenyl)-4-ethyl-1H-pyrazol-3-amine?
The IUPAC name of 5-(2,3-dimethylphenyl)-4-ethyl-1H-pyrazol-3-amine (CID 43670611) is 5-(2,3-dimethylphenyl)-4-ethyl-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(2,3-dimethylphenyl)-4-ethyl-1H-pyrazol-3-amine?
The canonical SMILES for 5-(2,3-dimethylphenyl)-4-ethyl-1H-pyrazol-3-amine is CCc1c(N)n[nH]c1-c1cccc(C)c1C.
What is the InChIKey of 5-(2,3-dimethylphenyl)-4-ethyl-1H-pyrazol-3-amine?
The InChIKey is ZWCUVGXNXYHKPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3/c1-4-10-12(15-16-13(10)14)11-7-5-6-8(2)9(11)3/h5-7H,4H2,1-3H3,(H3,14,15,16).
What are the key properties of 5-(2,3-dimethylphenyl)-4-ethyl-1H-pyrazol-3-amine?
5-(2,3-dimethylphenyl)-4-ethyl-1H-pyrazol-3-amine has a molecular weight of 215.30 g/mol, XLogP of 2.84, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,3-dimethylphenyl)-4-ethyl-1H-pyrazol-3-amine is sourced from PubChem (CID 43670611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).