2-[5-cyclopropyl-1-(2,3-dimethylphenyl)pyrazol-3-yl]ethanamine

C16H21N3 — CID 82088797

IUPAC2-[5-cyclopropyl-1-(2,3-dimethylphenyl)pyrazol-3-yl]ethanamine
SMILESCc1cccc(-n2nc(CCN)cc2C2CC2)c1C
InChIInChI=1S/C16H21N3/c1-11-4-3-5-15(12(11)2)19-16(13-6-7-13)10-14(18-19)8-9-17/h3-5,10,13H,6-9,17H2,1-2H3
InChIKeyWCBNKFNMOMRSQM-UHFFFAOYSA-N
MW255.36 g/mol
LogP2.87
Rot. Bonds4

About 2-[5-cyclopropyl-1-(2,3-dimethylphenyl)pyrazol-3-yl]ethanamine

2-[5-cyclopropyl-1-(2,3-dimethylphenyl)pyrazol-3-yl]ethanamine (PubChem CID 82088797) has the molecular formula C16H21N3 and a molecular weight of 255.36 g/mol. Its IUPAC name is 2-[5-cyclopropyl-1-(2,3-dimethylphenyl)pyrazol-3-yl]ethanamine.

Molecular Properties

Compound Name2-[5-cyclopropyl-1-(2,3-dimethylphenyl)pyrazol-3-yl]ethanamine
PubChem CID82088797
Molecular FormulaC16H21N3
Molecular Weight255.36 g/mol
Exact Mass255.17
IUPAC Name2-[5-cyclopropyl-1-(2,3-dimethylphenyl)pyrazol-3-yl]ethanamine
SMILESCc1cccc(-n2nc(CCN)cc2C2CC2)c1C
InChIInChI=1S/C16H21N3/c1-11-4-3-5-15(12(11)2)19-16(13-6-7-13)10-14(18-19)8-9-17/h3-5,10,13H,6-9,17H2,1-2H3
InChIKeyWCBNKFNMOMRSQM-UHFFFAOYSA-N
XLogP2.87
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[5-cyclopropyl-1-(2,3-dimethylphenyl)pyrazol-3-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-[1-(2,3-dimethylphenyl)-3,5-dimethylpyrazol-4-yl]ethanamine
CID 82085259
1-(2-bromophenyl)-5-cyclopropyl-3-ethylpyrazole
CID 139907319
[1-(3-chlorophenyl)-5-cyclopropylpyrazol-3-yl]methanamine
CID 82086673
[1-(2,3-dimethylphenyl)-5-(4-propan-2-ylphenyl)pyrazol-3-yl]methanamine
CID 82072619
[1-(2,3-dimethylphenyl)-5-propan-2-yl-1,2,4-triazol-3-yl]methanamine
CID 82478674
[5-cyclopropyl-1-(2,4,6-trimethylphenyl)pyrazol-3-yl]methanol
CID 82089024
2-[5-cyclopropyl-1-(3,4-dimethylphenyl)pyrazol-3-yl]acetonitrile
CID 82087736
1-(2,3-dimethylphenyl)-5-(oxolan-2-yl)pyrazole-3-carboxylic acid
CID 82361985
2-[1-(3-bromophenyl)-5-methylpyrazol-3-yl]ethanamine
CID 82093865
[5-(3,4-difluorophenyl)-1-(2,3-dimethylphenyl)triazol-4-yl]methanamine
CID 94936044
5-chloro-1-(2-methylphenyl)-3-propylpyrazole
CID 66022394
[1-(3-chloro-2-methylphenyl)-5-methylpyrazol-3-yl]methanamine
CID 82083524

Frequently Asked Questions

What is the IUPAC name of 2-[5-cyclopropyl-1-(2,3-dimethylphenyl)pyrazol-3-yl]ethanamine?
The IUPAC name of 2-[5-cyclopropyl-1-(2,3-dimethylphenyl)pyrazol-3-yl]ethanamine (CID 82088797) is 2-[5-cyclopropyl-1-(2,3-dimethylphenyl)pyrazol-3-yl]ethanamine.
What is the SMILES notation for 2-[5-cyclopropyl-1-(2,3-dimethylphenyl)pyrazol-3-yl]ethanamine?
The canonical SMILES for 2-[5-cyclopropyl-1-(2,3-dimethylphenyl)pyrazol-3-yl]ethanamine is Cc1cccc(-n2nc(CCN)cc2C2CC2)c1C.
What is the InChIKey of 2-[5-cyclopropyl-1-(2,3-dimethylphenyl)pyrazol-3-yl]ethanamine?
The InChIKey is WCBNKFNMOMRSQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3/c1-11-4-3-5-15(12(11)2)19-16(13-6-7-13)10-14(18-19)8-9-17/h3-5,10,13H,6-9,17H2,1-2H3.
What are the key properties of 2-[5-cyclopropyl-1-(2,3-dimethylphenyl)pyrazol-3-yl]ethanamine?
2-[5-cyclopropyl-1-(2,3-dimethylphenyl)pyrazol-3-yl]ethanamine has a molecular weight of 255.36 g/mol, XLogP of 2.87, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-cyclopropyl-1-(2,3-dimethylphenyl)pyrazol-3-yl]ethanamine is sourced from PubChem (CID 82088797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).