1-ethyl-3-methyl-5-pentan-2-yloxypyrazol-4-amine

C11H21N3O — CID 102980348

IUPAC1-ethyl-3-methyl-5-pentan-2-yloxypyrazol-4-amine
SMILESCCCC(C)Oc1c(N)c(C)nn1CC
InChIInChI=1S/C11H21N3O/c1-5-7-8(3)15-11-10(12)9(4)13-14(11)6-2/h8H,5-7,12H2,1-4H3
InChIKeyZZXOWHFINHFNIC-UHFFFAOYSA-N
MW211.31 g/mol
LogP2.36
Rot. Bonds5

About 1-ethyl-3-methyl-5-pentan-2-yloxypyrazol-4-amine

1-ethyl-3-methyl-5-pentan-2-yloxypyrazol-4-amine (PubChem CID 102980348) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 1-ethyl-3-methyl-5-pentan-2-yloxypyrazol-4-amine.

Molecular Properties

Compound Name1-ethyl-3-methyl-5-pentan-2-yloxypyrazol-4-amine
PubChem CID102980348
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name1-ethyl-3-methyl-5-pentan-2-yloxypyrazol-4-amine
SMILESCCCC(C)Oc1c(N)c(C)nn1CC
InChIInChI=1S/C11H21N3O/c1-5-7-8(3)15-11-10(12)9(4)13-14(11)6-2/h8H,5-7,12H2,1-4H3
InChIKeyZZXOWHFINHFNIC-UHFFFAOYSA-N
XLogP2.36
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-ethyl-3-methyl-5-pentan-2-yloxypyrazol-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-methyl-5-pentan-2-yloxypyrazol-4-amine?
The IUPAC name of 1-ethyl-3-methyl-5-pentan-2-yloxypyrazol-4-amine (CID 102980348) is 1-ethyl-3-methyl-5-pentan-2-yloxypyrazol-4-amine.
What is the SMILES notation for 1-ethyl-3-methyl-5-pentan-2-yloxypyrazol-4-amine?
The canonical SMILES for 1-ethyl-3-methyl-5-pentan-2-yloxypyrazol-4-amine is CCCC(C)Oc1c(N)c(C)nn1CC.
What is the InChIKey of 1-ethyl-3-methyl-5-pentan-2-yloxypyrazol-4-amine?
The InChIKey is ZZXOWHFINHFNIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-5-7-8(3)15-11-10(12)9(4)13-14(11)6-2/h8H,5-7,12H2,1-4H3.
What are the key properties of 1-ethyl-3-methyl-5-pentan-2-yloxypyrazol-4-amine?
1-ethyl-3-methyl-5-pentan-2-yloxypyrazol-4-amine has a molecular weight of 211.31 g/mol, XLogP of 2.36, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-methyl-5-pentan-2-yloxypyrazol-4-amine is sourced from PubChem (CID 102980348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).