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

C10H19N3 — CID 83530248

IUPAC1-methyl-3,4-di(propan-2-yl)pyrazol-5-amine
SMILESCC(C)c1nn(C)c(N)c1C(C)C
InChIInChI=1S/C10H19N3/c1-6(2)8-9(7(3)4)12-13(5)10(8)11/h6-7H,11H2,1-5H3
InChIKeyKWSIAWDCEWGXNS-UHFFFAOYSA-N
MW181.28 g/mol
LogP2.25
Rot. Bonds2

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

1-methyl-3,4-di(propan-2-yl)pyrazol-5-amine (PubChem CID 83530248) has the molecular formula C10H19N3 and a molecular weight of 181.28 g/mol. Its IUPAC name is 1-methyl-3,4-di(propan-2-yl)pyrazol-5-amine.

Molecular Properties

Compound Name1-methyl-3,4-di(propan-2-yl)pyrazol-5-amine
PubChem CID83530248
Molecular FormulaC10H19N3
Molecular Weight181.28 g/mol
Exact Mass181.16
IUPAC Name1-methyl-3,4-di(propan-2-yl)pyrazol-5-amine
SMILESCC(C)c1nn(C)c(N)c1C(C)C
InChIInChI=1S/C10H19N3/c1-6(2)8-9(7(3)4)12-13(5)10(8)11/h6-7H,11H2,1-5H3
InChIKeyKWSIAWDCEWGXNS-UHFFFAOYSA-N
XLogP2.25
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-3-propan-2-ylpyrazole-4,5-diamine
CID 66018774
1-methyl-3-propan-2-yl-4-(4-propan-2-ylphenyl)pyrazol-5-amine
CID 43336712
3-(7-bicyclo[4.1.0]heptanyl)-1-methyl-4-propan-2-ylpyrazol-5-amine
CID 113490622
3-(1,3-dimethylpyrazol-4-yl)-1-methyl-4-propan-2-ylpyrazol-5-amine
CID 102801702
3-(cyclohexylmethyl)-1-methyl-4-propan-2-ylpyrazol-5-amine
CID 113490620
1-methyl-5-N,3-di(propan-2-yl)pyrazole-4,5-diamine
CID 66017780
4-(2,4-dimethylphenyl)-1-methyl-3-propan-2-ylpyrazol-5-amine
CID 83544738
5-amino-3-(1-cyanoethyl)-1-methylpyrazole-4-carbonitrile
CID 83856530
1-(4-chloro-1-methyl-3-propan-2-ylpyrazol-5-yl)ethanamine
CID 83831978
1-(5-chloro-1-methyl-3-propan-2-ylpyrazol-4-yl)-2,2-difluoroethanol
CID 80605106
4-amino-N,N,1-trimethyl-3-propan-2-ylpyrazole-5-carboxamide
CID 20549829
1-[(4-amino-1-methyl-3-propan-2-ylpyrazol-5-yl)-methylamino]propan-2-ol
CID 66019786

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3,4-di(propan-2-yl)pyrazol-5-amine?
The IUPAC name of 1-methyl-3,4-di(propan-2-yl)pyrazol-5-amine (CID 83530248) is 1-methyl-3,4-di(propan-2-yl)pyrazol-5-amine.
What is the SMILES notation for 1-methyl-3,4-di(propan-2-yl)pyrazol-5-amine?
The canonical SMILES for 1-methyl-3,4-di(propan-2-yl)pyrazol-5-amine is CC(C)c1nn(C)c(N)c1C(C)C.
What is the InChIKey of 1-methyl-3,4-di(propan-2-yl)pyrazol-5-amine?
The InChIKey is KWSIAWDCEWGXNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3/c1-6(2)8-9(7(3)4)12-13(5)10(8)11/h6-7H,11H2,1-5H3.
What are the key properties of 1-methyl-3,4-di(propan-2-yl)pyrazol-5-amine?
1-methyl-3,4-di(propan-2-yl)pyrazol-5-amine has a molecular weight of 181.28 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3,4-di(propan-2-yl)pyrazol-5-amine is sourced from PubChem (CID 83530248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).