2-[3-(2-methoxyphenyl)-2-methyl-3,4-dihydropyrazol-5-yl]ethanamine

C13H19N3O — CID 82072518

IUPAC2-[3-(2-methoxyphenyl)-2-methyl-3,4-dihydropyrazol-5-yl]ethanamine
SMILESCOc1ccccc1C1CC(CCN)=NN1C
InChIInChI=1S/C13H19N3O/c1-16-12(9-10(15-16)7-8-14)11-5-3-4-6-13(11)17-2/h3-6,12H,7-9,14H2,1-2H3
InChIKeyWZLVYYFUTMTNPJ-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.78
Rot. Bonds4

About 2-[3-(2-methoxyphenyl)-2-methyl-3,4-dihydropyrazol-5-yl]ethanamine

2-[3-(2-methoxyphenyl)-2-methyl-3,4-dihydropyrazol-5-yl]ethanamine (PubChem CID 82072518) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 2-[3-(2-methoxyphenyl)-2-methyl-3,4-dihydropyrazol-5-yl]ethanamine.

Molecular Properties

Compound Name2-[3-(2-methoxyphenyl)-2-methyl-3,4-dihydropyrazol-5-yl]ethanamine
PubChem CID82072518
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name2-[3-(2-methoxyphenyl)-2-methyl-3,4-dihydropyrazol-5-yl]ethanamine
SMILESCOc1ccccc1C1CC(CCN)=NN1C
InChIInChI=1S/C13H19N3O/c1-16-12(9-10(15-16)7-8-14)11-5-3-4-6-13(11)17-2/h3-6,12H,7-9,14H2,1-2H3
InChIKeyWZLVYYFUTMTNPJ-UHFFFAOYSA-N
XLogP1.78
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[3-(2-methoxyphenyl)-2-methyl-3,4-dihydropyrazol-5-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

Related Compounds

2-[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-yl]ethanamine
CID 51657078
[2-(2,3-dimethylphenyl)-3-(2-methoxyphenyl)-3,4-dihydropyrazol-5-yl]methanamine
CID 82072542
[2-(5-chloro-2-methylphenyl)-3-(2-methoxyphenyl)-3,4-dihydropyrazol-5-yl]methanamine
CID 82072549
2-[3-(2-fluorophenyl)-2-(3-methoxyphenyl)-3,4-dihydropyrazol-5-yl]ethanamine
CID 82072721
2-[2-benzyl-3-(2-chlorophenyl)-3,4-dihydropyrazol-5-yl]ethanamine
CID 82072649
2-[3-(2-methoxyphenyl)pyrrolidin-1-yl]ethanamine
CID 23287971
2-(2-methoxyphenyl)-1-propylpiperidine
CID 102544278
2-amino-1-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]ethanone
CID 110096819
2-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]pyrimidine
CID 110258059
(3S)-2-(4-chlorophenyl)-3-(2-methoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazole
CID 7290384
3-(2-methoxyphenyl)-5-(4-methylphenyl)-2-phenyl-3,4-dihydropyrazole
CID 3714148
1-butan-2-yl-5-(2-methoxyphenyl)-4,5-dihydroimidazol-2-amine
CID 79514508

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-methoxyphenyl)-2-methyl-3,4-dihydropyrazol-5-yl]ethanamine?
The IUPAC name of 2-[3-(2-methoxyphenyl)-2-methyl-3,4-dihydropyrazol-5-yl]ethanamine (CID 82072518) is 2-[3-(2-methoxyphenyl)-2-methyl-3,4-dihydropyrazol-5-yl]ethanamine.
What is the SMILES notation for 2-[3-(2-methoxyphenyl)-2-methyl-3,4-dihydropyrazol-5-yl]ethanamine?
The canonical SMILES for 2-[3-(2-methoxyphenyl)-2-methyl-3,4-dihydropyrazol-5-yl]ethanamine is COc1ccccc1C1CC(CCN)=NN1C.
What is the InChIKey of 2-[3-(2-methoxyphenyl)-2-methyl-3,4-dihydropyrazol-5-yl]ethanamine?
The InChIKey is WZLVYYFUTMTNPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-16-12(9-10(15-16)7-8-14)11-5-3-4-6-13(11)17-2/h3-6,12H,7-9,14H2,1-2H3.
What are the key properties of 2-[3-(2-methoxyphenyl)-2-methyl-3,4-dihydropyrazol-5-yl]ethanamine?
2-[3-(2-methoxyphenyl)-2-methyl-3,4-dihydropyrazol-5-yl]ethanamine has a molecular weight of 233.31 g/mol, XLogP of 1.78, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-methoxyphenyl)-2-methyl-3,4-dihydropyrazol-5-yl]ethanamine is sourced from PubChem (CID 82072518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).