1-methyl-3-propan-2-yl-4-(4-propan-2-ylphenyl)pyrazol-5-amine

C16H23N3 — CID 43336712

IUPAC1-methyl-3-propan-2-yl-4-(4-propan-2-ylphenyl)pyrazol-5-amine
SMILESCC(C)c1ccc(-c2c(C(C)C)nn(C)c2N)cc1
InChIInChI=1S/C16H23N3/c1-10(2)12-6-8-13(9-7-12)14-15(11(3)4)18-19(5)16(14)17/h6-11H,17H2,1-5H3
InChIKeyVWDDGHZMFMNWIV-UHFFFAOYSA-N
MW257.38 g/mol
LogP3.92
Rot. Bonds3

About 1-methyl-3-propan-2-yl-4-(4-propan-2-ylphenyl)pyrazol-5-amine

1-methyl-3-propan-2-yl-4-(4-propan-2-ylphenyl)pyrazol-5-amine (PubChem CID 43336712) has the molecular formula C16H23N3 and a molecular weight of 257.38 g/mol. Its IUPAC name is 1-methyl-3-propan-2-yl-4-(4-propan-2-ylphenyl)pyrazol-5-amine.

Molecular Properties

Compound Name1-methyl-3-propan-2-yl-4-(4-propan-2-ylphenyl)pyrazol-5-amine
PubChem CID43336712
Molecular FormulaC16H23N3
Molecular Weight257.38 g/mol
Exact Mass257.19
IUPAC Name1-methyl-3-propan-2-yl-4-(4-propan-2-ylphenyl)pyrazol-5-amine
SMILESCC(C)c1ccc(-c2c(C(C)C)nn(C)c2N)cc1
InChIInChI=1S/C16H23N3/c1-10(2)12-6-8-13(9-7-12)14-15(11(3)4)18-19(5)16(14)17/h6-11H,17H2,1-5H3
InChIKeyVWDDGHZMFMNWIV-UHFFFAOYSA-N
XLogP3.92
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-3-(3-methylbutyl)-4-(4-propan-2-ylphenyl)pyrazol-5-amine
CID 43336708
4-(2,4-dimethylphenyl)-1-methyl-3-propan-2-ylpyrazol-5-amine
CID 83544738
3-(1-cyclopropylethyl)-1-methyl-4-phenylpyrazol-5-amine
CID 83154819
1-methyl-3-propan-2-ylpyrazole-4,5-diamine
CID 66018774
4-(4-ethoxyphenyl)-1-methyl-3-pentan-2-ylpyrazol-5-amine
CID 43336687
1-methyl-3-propan-2-yl-5-N-(4-propan-2-ylphenyl)pyrazole-4,5-diamine
CID 66018377
1-methyl-3,4-di(propan-2-yl)pyrazol-5-amine
CID 83530248
3-ethyl-5-(4-propan-2-ylphenyl)imidazol-4-amine
CID 62016973
4-(3,5-difluorophenyl)-1-methyl-3-pentan-3-ylpyrazol-5-amine
CID 61496782
4-(3-chlorophenyl)-1-methyl-3-pentan-2-ylpyrazol-5-amine
CID 43336306
3-butan-2-yl-1-methyl-4-(3-methylphenyl)pyrazol-5-amine
CID 62830810
4-(3-chlorophenyl)-3-(1-cyclopropylethyl)-1-methylpyrazol-5-amine
CID 83154614

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-propan-2-yl-4-(4-propan-2-ylphenyl)pyrazol-5-amine?
The IUPAC name of 1-methyl-3-propan-2-yl-4-(4-propan-2-ylphenyl)pyrazol-5-amine (CID 43336712) is 1-methyl-3-propan-2-yl-4-(4-propan-2-ylphenyl)pyrazol-5-amine.
What is the SMILES notation for 1-methyl-3-propan-2-yl-4-(4-propan-2-ylphenyl)pyrazol-5-amine?
The canonical SMILES for 1-methyl-3-propan-2-yl-4-(4-propan-2-ylphenyl)pyrazol-5-amine is CC(C)c1ccc(-c2c(C(C)C)nn(C)c2N)cc1.
What is the InChIKey of 1-methyl-3-propan-2-yl-4-(4-propan-2-ylphenyl)pyrazol-5-amine?
The InChIKey is VWDDGHZMFMNWIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3/c1-10(2)12-6-8-13(9-7-12)14-15(11(3)4)18-19(5)16(14)17/h6-11H,17H2,1-5H3.
What are the key properties of 1-methyl-3-propan-2-yl-4-(4-propan-2-ylphenyl)pyrazol-5-amine?
1-methyl-3-propan-2-yl-4-(4-propan-2-ylphenyl)pyrazol-5-amine has a molecular weight of 257.38 g/mol, XLogP of 3.92, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-propan-2-yl-4-(4-propan-2-ylphenyl)pyrazol-5-amine is sourced from PubChem (CID 43336712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).