N,1,2-trimethyl-5-phenylpyrazol-3-imine

C12H15N3 — CID 12982249

IUPACN,1,2-trimethyl-5-phenylpyrazol-3-imine
SMILESC/N=c1\cc(-c2ccccc2)n(C)n1C
InChIInChI=1S/C12H15N3/c1-13-12-9-11(14(2)15(12)3)10-7-5-4-6-8-10/h4-9H,1-3H3/b13-12+
InChIKeyAOSNOFXFNJCQTE-OUKQBFOZSA-N
MW201.27 g/mol
LogP1.56
Rot. Bonds1

About N,1,2-trimethyl-5-phenylpyrazol-3-imine

N,1,2-trimethyl-5-phenylpyrazol-3-imine (PubChem CID 12982249) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is N,1,2-trimethyl-5-phenylpyrazol-3-imine.

Molecular Properties

Compound NameN,1,2-trimethyl-5-phenylpyrazol-3-imine
PubChem CID12982249
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC NameN,1,2-trimethyl-5-phenylpyrazol-3-imine
SMILESC/N=c1\cc(-c2ccccc2)n(C)n1C
InChIInChI=1S/C12H15N3/c1-13-12-9-11(14(2)15(12)3)10-7-5-4-6-8-10/h4-9H,1-3H3/b13-12+
InChIKeyAOSNOFXFNJCQTE-OUKQBFOZSA-N
XLogP1.56
TPSA22.22 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N,N,N'-Trimethylbenzenecarboximidamide monohydrochloride
CID 3049214
(CH3)2N-C(C6H5)=Nch3
CID 3049215
1-Benzyl-2-methyl-4,5-dihydro-1H-imidazole
CID 10910074
3-Diazo-5-phenyl-3H-pyrazole
CID 12402193
N'-ethyl-N,N-dimethylbenzenecarboximidamide
CID 13129372
1-Benzyl-2-(cyanoimino)pyridine
CID 15650344
1-Benzyl-1-methylimidazol-1-ium
CID 87169512
7-(3-fluorophenyl)-3-methyl-2H-[1,2,4]triazolo[1,5-c]pyrimidine
CID 23459916
2-(4-Fluorophenyl)-1,1-dimethylimidazol-1-ium
CID 57189950
N-(1,2-dimethyl-5-phenylpyrazol-3-ylidene)-2,2,2-trifluoroacetamide
CID 57792270
(2E)-4-[(4-fluorophenyl)methyl-(methylideneamino)amino]-N',3-dimethylpenta-2,4-dienimidamide
CID 123153052
3-amino-3-(2-fluorophenyl)-N'-methylprop-2-enimidamide
CID 173226824

Frequently Asked Questions

What is the IUPAC name of N,1,2-trimethyl-5-phenylpyrazol-3-imine?
The IUPAC name of N,1,2-trimethyl-5-phenylpyrazol-3-imine (CID 12982249) is N,1,2-trimethyl-5-phenylpyrazol-3-imine.
What is the SMILES notation for N,1,2-trimethyl-5-phenylpyrazol-3-imine?
The canonical SMILES for N,1,2-trimethyl-5-phenylpyrazol-3-imine is C/N=c1\cc(-c2ccccc2)n(C)n1C.
What is the InChIKey of N,1,2-trimethyl-5-phenylpyrazol-3-imine?
The InChIKey is AOSNOFXFNJCQTE-OUKQBFOZSA-N. The full InChI is InChI=1S/C12H15N3/c1-13-12-9-11(14(2)15(12)3)10-7-5-4-6-8-10/h4-9H,1-3H3/b13-12+.
What are the key properties of N,1,2-trimethyl-5-phenylpyrazol-3-imine?
N,1,2-trimethyl-5-phenylpyrazol-3-imine has a molecular weight of 201.27 g/mol, XLogP of 1.56, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,2-trimethyl-5-phenylpyrazol-3-imine is sourced from PubChem (CID 12982249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).