3-ethyl-1-methylpyrazol-4-amine;hydrochloride

C6H12ClN3 — CID 91662822

IUPAC3-ethyl-1-methylpyrazol-4-amine;hydrochloride
SMILESCCc1nn(C)cc1N.Cl
InChIInChI=1S/C6H11N3.ClH/c1-3-6-5(7)4-9(2)8-6;/h4H,3,7H2,1-2H3;1H
InChIKeyDROGTSCOHNULDT-UHFFFAOYSA-N
MW161.64 g/mol
LogP0.99
Rot. Bonds1

About 3-ethyl-1-methylpyrazol-4-amine;hydrochloride

3-ethyl-1-methylpyrazol-4-amine;hydrochloride (PubChem CID 91662822) has the molecular formula C6H12ClN3 and a molecular weight of 161.64 g/mol. Its IUPAC name is 3-ethyl-1-methylpyrazol-4-amine;hydrochloride.

Molecular Properties

Compound Name3-ethyl-1-methylpyrazol-4-amine;hydrochloride
PubChem CID91662822
Molecular FormulaC6H12ClN3
Molecular Weight161.64 g/mol
Exact Mass161.07
IUPAC Name3-ethyl-1-methylpyrazol-4-amine;hydrochloride
SMILESCCc1nn(C)cc1N.Cl
InChIInChI=1S/C6H11N3.ClH/c1-3-6-5(7)4-9(2)8-6;/h4H,3,7H2,1-2H3;1H
InChIKeyDROGTSCOHNULDT-UHFFFAOYSA-N
XLogP0.99
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.64
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-ethyl-1-methylpyrazol-4-amine;hydrochloride 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

1,5-dimethyl-1H-pyrazol-4-amine
CID 573813
3-Ethyl-1-methyl-1H-pyrazole
CID 12581083
1,3-dimethyl-1H-pyrazol-4-amine hydrochloride
CID 12687197
1-ethyl-5-methyl-1H-pyrazol-4-amine
CID 7019324
1,3-dimethyl-1H-pyrazol-4-amine
CID 4431056
1-(1-Ethyl-1H-pyrazol-3-yl)ethan-1-amine
CID 17024749
1,3-dimethyl-1H-pyrazol-4-amine dihydrochloride
CID 17349594
1-ethyl-5-methyl-1H-pyrazol-4-amine dihydrochloride
CID 17349595
1-(1-ethyl-1H-pyrazol-5-yl)ethan-1-amine
CID 19585894
alpha,1-Dimethyl-1H-pyrazole-3-methanamine
CID 19616543
1-(1-methyl-1H-pyrazol-5-yl)ethan-1-amine
CID 19616958
3-Methyl-1-(2,2,2-trifluoroethyl)-1H-pyrazol-4-amine
CID 19619547

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-methylpyrazol-4-amine;hydrochloride?
The IUPAC name of 3-ethyl-1-methylpyrazol-4-amine;hydrochloride (CID 91662822) is 3-ethyl-1-methylpyrazol-4-amine;hydrochloride.
What is the SMILES notation for 3-ethyl-1-methylpyrazol-4-amine;hydrochloride?
The canonical SMILES for 3-ethyl-1-methylpyrazol-4-amine;hydrochloride is CCc1nn(C)cc1N.Cl.
What is the InChIKey of 3-ethyl-1-methylpyrazol-4-amine;hydrochloride?
The InChIKey is DROGTSCOHNULDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3.ClH/c1-3-6-5(7)4-9(2)8-6;/h4H,3,7H2,1-2H3;1H.
What are the key properties of 3-ethyl-1-methylpyrazol-4-amine;hydrochloride?
3-ethyl-1-methylpyrazol-4-amine;hydrochloride has a molecular weight of 161.64 g/mol, XLogP of 0.99, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-methylpyrazol-4-amine;hydrochloride is sourced from PubChem (CID 91662822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).