[1-(1-cyclopropylethyl)-3,5-dimethylpyrazol-4-yl]methanamine

C11H19N3 — CID 61270347

IUPAC[1-(1-cyclopropylethyl)-3,5-dimethylpyrazol-4-yl]methanamine
SMILESCc1nn(C(C)C2CC2)c(C)c1CN
InChIInChI=1S/C11H19N3/c1-7-11(6-12)9(3)14(13-7)8(2)10-4-5-10/h8,10H,4-6,12H2,1-3H3
InChIKeyTWSRCAVGZPPZEM-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.93
Rot. Bonds3

About [1-(1-cyclopropylethyl)-3,5-dimethylpyrazol-4-yl]methanamine

[1-(1-cyclopropylethyl)-3,5-dimethylpyrazol-4-yl]methanamine (PubChem CID 61270347) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is [1-(1-cyclopropylethyl)-3,5-dimethylpyrazol-4-yl]methanamine.

Molecular Properties

Compound Name[1-(1-cyclopropylethyl)-3,5-dimethylpyrazol-4-yl]methanamine
PubChem CID61270347
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name[1-(1-cyclopropylethyl)-3,5-dimethylpyrazol-4-yl]methanamine
SMILESCc1nn(C(C)C2CC2)c(C)c1CN
InChIInChI=1S/C11H19N3/c1-7-11(6-12)9(3)14(13-7)8(2)10-4-5-10/h8,10H,4-6,12H2,1-3H3
InChIKeyTWSRCAVGZPPZEM-UHFFFAOYSA-N
XLogP1.93
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-(1-cyclopropylethyl)-3,5-dimethylpyrazol-4-yl]methanamine 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-(1-cyclopropylethyl)-3,5-dimethylpyrazol-4-yl]methanamine?
The IUPAC name of [1-(1-cyclopropylethyl)-3,5-dimethylpyrazol-4-yl]methanamine (CID 61270347) is [1-(1-cyclopropylethyl)-3,5-dimethylpyrazol-4-yl]methanamine.
What is the SMILES notation for [1-(1-cyclopropylethyl)-3,5-dimethylpyrazol-4-yl]methanamine?
The canonical SMILES for [1-(1-cyclopropylethyl)-3,5-dimethylpyrazol-4-yl]methanamine is Cc1nn(C(C)C2CC2)c(C)c1CN.
What is the InChIKey of [1-(1-cyclopropylethyl)-3,5-dimethylpyrazol-4-yl]methanamine?
The InChIKey is TWSRCAVGZPPZEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-7-11(6-12)9(3)14(13-7)8(2)10-4-5-10/h8,10H,4-6,12H2,1-3H3.
What are the key properties of [1-(1-cyclopropylethyl)-3,5-dimethylpyrazol-4-yl]methanamine?
[1-(1-cyclopropylethyl)-3,5-dimethylpyrazol-4-yl]methanamine has a molecular weight of 193.29 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-cyclopropylethyl)-3,5-dimethylpyrazol-4-yl]methanamine is sourced from PubChem (CID 61270347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).