[5-(2-ethylpyrrolidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanamine

C12H22N4 — CID 60974475

IUPAC[5-(2-ethylpyrrolidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanamine
SMILESCCC1CCCN1c1c(CN)c(C)nn1C
InChIInChI=1S/C12H22N4/c1-4-10-6-5-7-16(10)12-11(8-13)9(2)14-15(12)3/h10H,4-8,13H2,1-3H3
InChIKeyQZBTUGDKNXOZDQ-UHFFFAOYSA-N
MW222.34 g/mol
LogP1.57
Rot. Bonds3

About [5-(2-ethylpyrrolidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanamine

[5-(2-ethylpyrrolidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanamine (PubChem CID 60974475) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is [5-(2-ethylpyrrolidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanamine.

Molecular Properties

Compound Name[5-(2-ethylpyrrolidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanamine
PubChem CID60974475
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC Name[5-(2-ethylpyrrolidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanamine
SMILESCCC1CCCN1c1c(CN)c(C)nn1C
InChIInChI=1S/C12H22N4/c1-4-10-6-5-7-16(10)12-11(8-13)9(2)14-15(12)3/h10H,4-8,13H2,1-3H3
InChIKeyQZBTUGDKNXOZDQ-UHFFFAOYSA-N
XLogP1.57
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 ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [5-(2-ethylpyrrolidin-1-yl)-1,3-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

Related Compounds

[1-[4-(aminomethyl)-1,3-dimethylpyrazol-5-yl]azepan-2-yl]methanol
CID 116634087
[5-(2-ethylpiperidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanol
CID 43266645
2-[5-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-1,3-dimethylpyrazol-4-yl]ethanamine
CID 63784094
2-[1,3-dimethyl-5-(2-propylpiperidin-1-yl)pyrazol-4-yl]ethanamine
CID 83057672
[1,3-dimethyl-5-(3-methylpiperidin-1-yl)pyrazol-4-yl]methanamine
CID 43122238
2-[1,3-dimethyl-5-(2-methylpyrrolidin-1-yl)pyrazol-4-yl]ethanamine
CID 63782509
[1-[4-(aminomethyl)-1,3-dimethylpyrazol-5-yl]piperidin-3-yl]methanol
CID 43590482
1-[1,3-dimethyl-5-(2-methylpyrrolidin-1-yl)pyrazol-4-yl]butan-2-amine
CID 55237371
[1,3-dimethyl-5-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrazol-4-yl]methanamine
CID 55241142
[5-(4,4-dimethylazepan-1-yl)-1,3-dimethylpyrazol-4-yl]methanamine
CID 65283757
[5-(8-azaspiro[4.5]decan-8-yl)-1,3-dimethylpyrazol-4-yl]methanamine
CID 55225901
[1,3-dimethyl-5-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyrazol-4-yl]methanamine
CID 66392435

Frequently Asked Questions

What is the IUPAC name of [5-(2-ethylpyrrolidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanamine?
The IUPAC name of [5-(2-ethylpyrrolidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanamine (CID 60974475) is [5-(2-ethylpyrrolidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanamine.
What is the SMILES notation for [5-(2-ethylpyrrolidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanamine?
The canonical SMILES for [5-(2-ethylpyrrolidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanamine is CCC1CCCN1c1c(CN)c(C)nn1C.
What is the InChIKey of [5-(2-ethylpyrrolidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanamine?
The InChIKey is QZBTUGDKNXOZDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4/c1-4-10-6-5-7-16(10)12-11(8-13)9(2)14-15(12)3/h10H,4-8,13H2,1-3H3.
What are the key properties of [5-(2-ethylpyrrolidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanamine?
[5-(2-ethylpyrrolidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanamine has a molecular weight of 222.34 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2-ethylpyrrolidin-1-yl)-1,3-dimethylpyrazol-4-yl]methanamine is sourced from PubChem (CID 60974475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).