3-(1,3-dimethylpyrazol-4-yl)-1-methyl-4-propan-2-ylpyrazol-5-amine

C12H19N5 — CID 102801702

IUPAC3-(1,3-dimethylpyrazol-4-yl)-1-methyl-4-propan-2-ylpyrazol-5-amine
SMILESCc1nn(C)cc1-c1nn(C)c(N)c1C(C)C
InChIInChI=1S/C12H19N5/c1-7(2)10-11(15-17(5)12(10)13)9-6-16(4)14-8(9)3/h6-7H,13H2,1-5H3
InChIKeyZYIOPYRRRBCLNV-UHFFFAOYSA-N
MW233.32 g/mol
LogP1.83
Rot. Bonds2

About 3-(1,3-dimethylpyrazol-4-yl)-1-methyl-4-propan-2-ylpyrazol-5-amine

3-(1,3-dimethylpyrazol-4-yl)-1-methyl-4-propan-2-ylpyrazol-5-amine (PubChem CID 102801702) has the molecular formula C12H19N5 and a molecular weight of 233.32 g/mol. Its IUPAC name is 3-(1,3-dimethylpyrazol-4-yl)-1-methyl-4-propan-2-ylpyrazol-5-amine.

Molecular Properties

Compound Name3-(1,3-dimethylpyrazol-4-yl)-1-methyl-4-propan-2-ylpyrazol-5-amine
PubChem CID102801702
Molecular FormulaC12H19N5
Molecular Weight233.32 g/mol
Exact Mass233.16
IUPAC Name3-(1,3-dimethylpyrazol-4-yl)-1-methyl-4-propan-2-ylpyrazol-5-amine
SMILESCc1nn(C)cc1-c1nn(C)c(N)c1C(C)C
InChIInChI=1S/C12H19N5/c1-7(2)10-11(15-17(5)12(10)13)9-6-16(4)14-8(9)3/h6-7H,13H2,1-5H3
InChIKeyZYIOPYRRRBCLNV-UHFFFAOYSA-N
XLogP1.83
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.32
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(1,3-dimethylpyrazol-4-yl)-2,3-dimethylimidazol-4-amine
CID 83092115
3-(1,3-dimethylpyrazol-4-yl)pyrazin-2-amine
CID 112559104
3-(1,3-dimethylpyrazol-4-yl)-1-(3-methylbutyl)pyrazol-4-amine
CID 83222656
1-methyl-3,4-di(propan-2-yl)pyrazol-5-amine
CID 83530248
3-(1,3-dimethylpyrazol-4-yl)-1-ethylpyrazol-4-amine
CID 19621294
2-(1,3-dimethylpyrazol-4-yl)-5-propan-2-yl-1,3,4-oxadiazole
CID 169163056
3-(1,3-dimethylpyrazol-4-yl)-2-methylaniline
CID 107627174
3-(1,3-dimethylpyrazol-4-yl)-5-methylaniline
CID 107579808
1-(4-bromophenyl)-3-(1,3-dimethylpyrazol-4-yl)pyrazol-4-amine
CID 83222401
3-(1,3-dimethylpyrazol-4-yl)-1-(3-methylbutyl)pyrazole-4-carbaldehyde
CID 61414870
2-(1,3-dimethylpyrazol-4-yl)-6-(2-methylpropyl)pyrimidin-4-amine
CID 83094220
2-cyclopentyl-5-(1,3-dimethylpyrazol-4-yl)-3-ethylimidazol-4-amine
CID 83090632

Frequently Asked Questions

What is the IUPAC name of 3-(1,3-dimethylpyrazol-4-yl)-1-methyl-4-propan-2-ylpyrazol-5-amine?
The IUPAC name of 3-(1,3-dimethylpyrazol-4-yl)-1-methyl-4-propan-2-ylpyrazol-5-amine (CID 102801702) is 3-(1,3-dimethylpyrazol-4-yl)-1-methyl-4-propan-2-ylpyrazol-5-amine.
What is the SMILES notation for 3-(1,3-dimethylpyrazol-4-yl)-1-methyl-4-propan-2-ylpyrazol-5-amine?
The canonical SMILES for 3-(1,3-dimethylpyrazol-4-yl)-1-methyl-4-propan-2-ylpyrazol-5-amine is Cc1nn(C)cc1-c1nn(C)c(N)c1C(C)C.
What is the InChIKey of 3-(1,3-dimethylpyrazol-4-yl)-1-methyl-4-propan-2-ylpyrazol-5-amine?
The InChIKey is ZYIOPYRRRBCLNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5/c1-7(2)10-11(15-17(5)12(10)13)9-6-16(4)14-8(9)3/h6-7H,13H2,1-5H3.
What are the key properties of 3-(1,3-dimethylpyrazol-4-yl)-1-methyl-4-propan-2-ylpyrazol-5-amine?
3-(1,3-dimethylpyrazol-4-yl)-1-methyl-4-propan-2-ylpyrazol-5-amine has a molecular weight of 233.32 g/mol, XLogP of 1.83, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,3-dimethylpyrazol-4-yl)-1-methyl-4-propan-2-ylpyrazol-5-amine is sourced from PubChem (CID 102801702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).