2-[1,3-dimethyl-5-(2-methylpyrrolidin-1-yl)pyrazol-4-yl]ethanamine

C12H22N4 — CID 63782509

IUPAC2-[1,3-dimethyl-5-(2-methylpyrrolidin-1-yl)pyrazol-4-yl]ethanamine
SMILESCc1nn(C)c(N2CCCC2C)c1CCN
InChIInChI=1S/C12H22N4/c1-9-5-4-8-16(9)12-11(6-7-13)10(2)14-15(12)3/h9H,4-8,13H2,1-3H3
InChIKeyWEFKQOODHZPIDM-UHFFFAOYSA-N
MW222.34 g/mol
LogP1.22
Rot. Bonds3

About 2-[1,3-dimethyl-5-(2-methylpyrrolidin-1-yl)pyrazol-4-yl]ethanamine

2-[1,3-dimethyl-5-(2-methylpyrrolidin-1-yl)pyrazol-4-yl]ethanamine (PubChem CID 63782509) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is 2-[1,3-dimethyl-5-(2-methylpyrrolidin-1-yl)pyrazol-4-yl]ethanamine.

Molecular Properties

Compound Name2-[1,3-dimethyl-5-(2-methylpyrrolidin-1-yl)pyrazol-4-yl]ethanamine
PubChem CID63782509
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC Name2-[1,3-dimethyl-5-(2-methylpyrrolidin-1-yl)pyrazol-4-yl]ethanamine
SMILESCc1nn(C)c(N2CCCC2C)c1CCN
InChIInChI=1S/C12H22N4/c1-9-5-4-8-16(9)12-11(6-7-13)10(2)14-15(12)3/h9H,4-8,13H2,1-3H3
InChIKeyWEFKQOODHZPIDM-UHFFFAOYSA-N
XLogP1.22
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.34
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[1,3-dimethyl-5-(2-methylpyrrolidin-1-yl)pyrazol-4-yl]ethanamine 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 2-[1,3-dimethyl-5-(2-methylpyrrolidin-1-yl)pyrazol-4-yl]ethanamine?
The IUPAC name of 2-[1,3-dimethyl-5-(2-methylpyrrolidin-1-yl)pyrazol-4-yl]ethanamine (CID 63782509) is 2-[1,3-dimethyl-5-(2-methylpyrrolidin-1-yl)pyrazol-4-yl]ethanamine.
What is the SMILES notation for 2-[1,3-dimethyl-5-(2-methylpyrrolidin-1-yl)pyrazol-4-yl]ethanamine?
The canonical SMILES for 2-[1,3-dimethyl-5-(2-methylpyrrolidin-1-yl)pyrazol-4-yl]ethanamine is Cc1nn(C)c(N2CCCC2C)c1CCN.
What is the InChIKey of 2-[1,3-dimethyl-5-(2-methylpyrrolidin-1-yl)pyrazol-4-yl]ethanamine?
The InChIKey is WEFKQOODHZPIDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4/c1-9-5-4-8-16(9)12-11(6-7-13)10(2)14-15(12)3/h9H,4-8,13H2,1-3H3.
What are the key properties of 2-[1,3-dimethyl-5-(2-methylpyrrolidin-1-yl)pyrazol-4-yl]ethanamine?
2-[1,3-dimethyl-5-(2-methylpyrrolidin-1-yl)pyrazol-4-yl]ethanamine has a molecular weight of 222.34 g/mol, XLogP of 1.22, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1,3-dimethyl-5-(2-methylpyrrolidin-1-yl)pyrazol-4-yl]ethanamine is sourced from PubChem (CID 63782509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).