N-(2-ethylphenyl)-1-methylpyrazol-4-amine

C12H15N3 — CID 125450471

IUPACN-(2-ethylphenyl)-1-methylpyrazol-4-amine
SMILESCCc1ccccc1Nc1cnn(C)c1
InChIInChI=1S/C12H15N3/c1-3-10-6-4-5-7-12(10)14-11-8-13-15(2)9-11/h4-9,14H,3H2,1-2H3
InChIKeyYJTAOQMAQBEODS-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.73
Rot. Bonds3

About N-(2-ethylphenyl)-1-methylpyrazol-4-amine

N-(2-ethylphenyl)-1-methylpyrazol-4-amine (PubChem CID 125450471) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is N-(2-ethylphenyl)-1-methylpyrazol-4-amine.

Molecular Properties

Compound NameN-(2-ethylphenyl)-1-methylpyrazol-4-amine
PubChem CID125450471
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC NameN-(2-ethylphenyl)-1-methylpyrazol-4-amine
SMILESCCc1ccccc1Nc1cnn(C)c1
InChIInChI=1S/C12H15N3/c1-3-10-6-4-5-7-12(10)14-11-8-13-15(2)9-11/h4-9,14H,3H2,1-2H3
InChIKeyYJTAOQMAQBEODS-UHFFFAOYSA-N
XLogP2.73
TPSA29.85 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 ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-N-[(1-methylpyrazol-4-yl)methyl]aniline
CID 28600445
4-(2-ethylanilino)benzenethiol
CID 166755248
N-(2-ethylphenyl)-1H-pyrazol-4-amine
CID 125449698
4-N-(2-ethylphenyl)-1-N-methylbenzene-1,4-diamine
CID 117027221
2-(ethylamino)-N-(1-methylpyrazol-4-yl)benzenesulfonamide
CID 62146252
5-N-(2-ethylphenyl)-3-N-methylpyridine-3,5-diamine
CID 104532392
2-ethylsulfanyl-6-[(1-methylpyrazol-4-yl)amino]benzonitrile
CID 113385503
N-[(2-ethoxyphenyl)methyl]-1-methylpyrazol-4-amine
CID 43535024
2-fluoro-6-[(1-methylpyrazol-4-yl)amino]benzonitrile
CID 78916028
4-N-(2-ethylphenyl)-1H-pyrazole-4,5-diamine
CID 82236252
N-(2,4-dimethylphenyl)-1-methylpyrazol-4-amine
CID 125449684
N-(2,6-difluorophenyl)-1-methylpyrazol-4-amine
CID 82536854

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-1-methylpyrazol-4-amine?
The IUPAC name of N-(2-ethylphenyl)-1-methylpyrazol-4-amine (CID 125450471) is N-(2-ethylphenyl)-1-methylpyrazol-4-amine.
What is the SMILES notation for N-(2-ethylphenyl)-1-methylpyrazol-4-amine?
The canonical SMILES for N-(2-ethylphenyl)-1-methylpyrazol-4-amine is CCc1ccccc1Nc1cnn(C)c1.
What is the InChIKey of N-(2-ethylphenyl)-1-methylpyrazol-4-amine?
The InChIKey is YJTAOQMAQBEODS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-3-10-6-4-5-7-12(10)14-11-8-13-15(2)9-11/h4-9,14H,3H2,1-2H3.
What are the key properties of N-(2-ethylphenyl)-1-methylpyrazol-4-amine?
N-(2-ethylphenyl)-1-methylpyrazol-4-amine has a molecular weight of 201.27 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-1-methylpyrazol-4-amine is sourced from PubChem (CID 125450471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).