N,1-dimethyl-5-(4-methylphenyl)pyrazol-3-amine

C12H15N3 — CID 116827378

IUPACN,1-dimethyl-5-(4-methylphenyl)pyrazol-3-amine
SMILESCNc1cc(-c2ccc(C)cc2)n(C)n1
InChIInChI=1S/C12H15N3/c1-9-4-6-10(7-5-9)11-8-12(13-2)14-15(11)3/h4-8H,1-3H3,(H,13,14)
InChIKeyRQKQISLLSPAXDM-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.44
Rot. Bonds2

About N,1-dimethyl-5-(4-methylphenyl)pyrazol-3-amine

N,1-dimethyl-5-(4-methylphenyl)pyrazol-3-amine (PubChem CID 116827378) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is N,1-dimethyl-5-(4-methylphenyl)pyrazol-3-amine.

Molecular Properties

Compound NameN,1-dimethyl-5-(4-methylphenyl)pyrazol-3-amine
PubChem CID116827378
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC NameN,1-dimethyl-5-(4-methylphenyl)pyrazol-3-amine
SMILESCNc1cc(-c2ccc(C)cc2)n(C)n1
InChIInChI=1S/C12H15N3/c1-9-4-6-10(7-5-9)11-8-12(13-2)14-15(11)3/h4-8H,1-3H3,(H,13,14)
InChIKeyRQKQISLLSPAXDM-UHFFFAOYSA-N
XLogP2.44
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,1-dimethyl-5-(1H-pyrrol-3-yl)pyrazol-3-amine
CID 136995824
N,1-dimethyl-5-(5-methylfuran-2-yl)pyrazol-3-amine
CID 116827492
5-(3-fluoro-4-methoxyphenyl)-N,1-dimethylpyrazol-3-amine
CID 116827395
5-(2-methoxyphenyl)-N,1-dimethylpyrazol-3-amine
CID 116827490
5-(5-chloro-2-methoxy-4-methylphenyl)-N,1-dimethylpyrazol-3-amine
CID 116827428
1-(3,5-dimethylphenyl)-3-(1-methyl-5-phenylpyrazol-3-yl)urea
CID 108813110
5-(1H-indol-3-yl)-N,1-dimethylpyrazol-3-amine
CID 136995821
5-(4-tert-butylphenyl)-1,3-dimethylpyrazole
CID 116856714
N-methyl-1-(1-methyl-5-phenylpyrazol-3-yl)ethanamine
CID 105469038
N,1-dimethyl-5-(trifluoromethyl)pyrazol-3-amine
CID 131121157
1,5-dimethyl-3-(4-methylphenyl)pyrazole
CID 10679126
1-[5-(4-fluorophenyl)-1-methylpyrazol-3-yl]-3-(1H-pyrazol-4-yl)urea
CID 166293798

Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-5-(4-methylphenyl)pyrazol-3-amine?
The IUPAC name of N,1-dimethyl-5-(4-methylphenyl)pyrazol-3-amine (CID 116827378) is N,1-dimethyl-5-(4-methylphenyl)pyrazol-3-amine.
What is the SMILES notation for N,1-dimethyl-5-(4-methylphenyl)pyrazol-3-amine?
The canonical SMILES for N,1-dimethyl-5-(4-methylphenyl)pyrazol-3-amine is CNc1cc(-c2ccc(C)cc2)n(C)n1.
What is the InChIKey of N,1-dimethyl-5-(4-methylphenyl)pyrazol-3-amine?
The InChIKey is RQKQISLLSPAXDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-9-4-6-10(7-5-9)11-8-12(13-2)14-15(11)3/h4-8H,1-3H3,(H,13,14).
What are the key properties of N,1-dimethyl-5-(4-methylphenyl)pyrazol-3-amine?
N,1-dimethyl-5-(4-methylphenyl)pyrazol-3-amine has a molecular weight of 201.27 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-5-(4-methylphenyl)pyrazol-3-amine is sourced from PubChem (CID 116827378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).