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

C12H19N5 — CID 66011180

IUPAC5-(2-ethylimidazol-1-yl)-1-methyl-3-propan-2-ylpyrazol-4-amine
SMILESCCc1nccn1-c1c(N)c(C(C)C)nn1C
InChIInChI=1S/C12H19N5/c1-5-9-14-6-7-17(9)12-10(13)11(8(2)3)15-16(12)4/h6-8H,5,13H2,1-4H3
InChIKeyQFEBPIDCPJNWBV-UHFFFAOYSA-N
MW233.32 g/mol
LogP1.87
Rot. Bonds3

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

5-(2-ethylimidazol-1-yl)-1-methyl-3-propan-2-ylpyrazol-4-amine (PubChem CID 66011180) has the molecular formula C12H19N5 and a molecular weight of 233.32 g/mol. Its IUPAC name is 5-(2-ethylimidazol-1-yl)-1-methyl-3-propan-2-ylpyrazol-4-amine.

Molecular Properties

Compound Name5-(2-ethylimidazol-1-yl)-1-methyl-3-propan-2-ylpyrazol-4-amine
PubChem CID66011180
Molecular FormulaC12H19N5
Molecular Weight233.32 g/mol
Exact Mass233.16
IUPAC Name5-(2-ethylimidazol-1-yl)-1-methyl-3-propan-2-ylpyrazol-4-amine
SMILESCCc1nccn1-c1c(N)c(C(C)C)nn1C
InChIInChI=1S/C12H19N5/c1-5-9-14-6-7-17(9)12-10(13)11(8(2)3)15-16(12)4/h6-8H,5,13H2,1-4H3
InChIKeyQFEBPIDCPJNWBV-UHFFFAOYSA-N
XLogP1.87
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.32
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(2-ethylimidazol-1-yl)-1-methyl-3-propan-2-ylpyrazol-4-amine?
The IUPAC name of 5-(2-ethylimidazol-1-yl)-1-methyl-3-propan-2-ylpyrazol-4-amine (CID 66011180) is 5-(2-ethylimidazol-1-yl)-1-methyl-3-propan-2-ylpyrazol-4-amine.
What is the SMILES notation for 5-(2-ethylimidazol-1-yl)-1-methyl-3-propan-2-ylpyrazol-4-amine?
The canonical SMILES for 5-(2-ethylimidazol-1-yl)-1-methyl-3-propan-2-ylpyrazol-4-amine is CCc1nccn1-c1c(N)c(C(C)C)nn1C.
What is the InChIKey of 5-(2-ethylimidazol-1-yl)-1-methyl-3-propan-2-ylpyrazol-4-amine?
The InChIKey is QFEBPIDCPJNWBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5/c1-5-9-14-6-7-17(9)12-10(13)11(8(2)3)15-16(12)4/h6-8H,5,13H2,1-4H3.
What are the key properties of 5-(2-ethylimidazol-1-yl)-1-methyl-3-propan-2-ylpyrazol-4-amine?
5-(2-ethylimidazol-1-yl)-1-methyl-3-propan-2-ylpyrazol-4-amine has a molecular weight of 233.32 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethylimidazol-1-yl)-1-methyl-3-propan-2-ylpyrazol-4-amine is sourced from PubChem (CID 66011180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).