[4-(3-ethyl-1-methylpyrazol-4-yl)thiophen-2-yl]methanamine

C11H15N3S — CID 66008902

IUPAC[4-(3-ethyl-1-methylpyrazol-4-yl)thiophen-2-yl]methanamine
SMILESCCc1nn(C)cc1-c1csc(CN)c1
InChIInChI=1S/C11H15N3S/c1-3-11-10(6-14(2)13-11)8-4-9(5-12)15-7-8/h4,6-7H,3,5,12H2,1-2H3
InChIKeyOFFUNCAPXXWEOT-UHFFFAOYSA-N
MW221.33 g/mol
LogP2.17
Rot. Bonds3

About [4-(3-ethyl-1-methylpyrazol-4-yl)thiophen-2-yl]methanamine

[4-(3-ethyl-1-methylpyrazol-4-yl)thiophen-2-yl]methanamine (PubChem CID 66008902) has the molecular formula C11H15N3S and a molecular weight of 221.33 g/mol. Its IUPAC name is [4-(3-ethyl-1-methylpyrazol-4-yl)thiophen-2-yl]methanamine.

Molecular Properties

Compound Name[4-(3-ethyl-1-methylpyrazol-4-yl)thiophen-2-yl]methanamine
PubChem CID66008902
Molecular FormulaC11H15N3S
Molecular Weight221.33 g/mol
Exact Mass221.10
IUPAC Name[4-(3-ethyl-1-methylpyrazol-4-yl)thiophen-2-yl]methanamine
SMILESCCc1nn(C)cc1-c1csc(CN)c1
InChIInChI=1S/C11H15N3S/c1-3-11-10(6-14(2)13-11)8-4-9(5-12)15-7-8/h4,6-7H,3,5,12H2,1-2H3
InChIKeyOFFUNCAPXXWEOT-UHFFFAOYSA-N
XLogP2.17
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.33
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [4-(3-ethyl-1-methylpyrazol-4-yl)thiophen-2-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

[3-(3-ethyl-1-methylpyrazol-4-yl)-1,2-oxazol-5-yl]methanamine
CID 112671322
[4-(3-methyl-1-propan-2-ylpyrazol-4-yl)thiophen-2-yl]methanamine
CID 66021449
3-ethyl-1-methyl-4-(4-methylphenyl)pyrazole
CID 70791517
4-(3-ethyl-1-methylpyrazol-4-yl)-2-methylaniline
CID 66008901
[2-(3-ethyl-1-methylpyrazol-4-yl)phenyl]methanamine
CID 66008084
4-(3-ethyl-1-methylpyrazol-4-yl)-2-fluoroaniline
CID 66008493
ethyl 2-[2-(3-ethyl-1-methylpyrazol-4-yl)-1,3-thiazol-4-yl]acetate
CID 112670102
[4-(3-ethyl-1-methylpyrazol-4-yl)-3-fluorophenyl]methanamine
CID 81442406
2-[3-(3-ethyl-1-methylpyrazol-4-yl)-1,2-oxazol-5-yl]ethanamine
CID 116642485
3-ethyl-4-(4-methoxyphenyl)-1-methylpyrazole
CID 70834828
2-[5-(3-ethyl-1-methylpyrazol-4-yl)-1,3-oxazol-2-yl]ethanamine
CID 102811468
3-(3-ethyl-1-methylpyrazol-4-yl)-4-fluoroaniline
CID 104781283

Frequently Asked Questions

What is the IUPAC name of [4-(3-ethyl-1-methylpyrazol-4-yl)thiophen-2-yl]methanamine?
The IUPAC name of [4-(3-ethyl-1-methylpyrazol-4-yl)thiophen-2-yl]methanamine (CID 66008902) is [4-(3-ethyl-1-methylpyrazol-4-yl)thiophen-2-yl]methanamine.
What is the SMILES notation for [4-(3-ethyl-1-methylpyrazol-4-yl)thiophen-2-yl]methanamine?
The canonical SMILES for [4-(3-ethyl-1-methylpyrazol-4-yl)thiophen-2-yl]methanamine is CCc1nn(C)cc1-c1csc(CN)c1.
What is the InChIKey of [4-(3-ethyl-1-methylpyrazol-4-yl)thiophen-2-yl]methanamine?
The InChIKey is OFFUNCAPXXWEOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3S/c1-3-11-10(6-14(2)13-11)8-4-9(5-12)15-7-8/h4,6-7H,3,5,12H2,1-2H3.
What are the key properties of [4-(3-ethyl-1-methylpyrazol-4-yl)thiophen-2-yl]methanamine?
[4-(3-ethyl-1-methylpyrazol-4-yl)thiophen-2-yl]methanamine has a molecular weight of 221.33 g/mol, XLogP of 2.17, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-ethyl-1-methylpyrazol-4-yl)thiophen-2-yl]methanamine is sourced from PubChem (CID 66008902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).