[3-(2-methylpropyl)phenyl]-(2-methylpyrazol-3-yl)methanamine

C15H21N3 — CID 105188165

IUPAC[3-(2-methylpropyl)phenyl]-(2-methylpyrazol-3-yl)methanamine
SMILESCC(C)Cc1cccc(C(N)c2ccnn2C)c1
InChIInChI=1S/C15H21N3/c1-11(2)9-12-5-4-6-13(10-12)15(16)14-7-8-17-18(14)3/h4-8,10-11,15H,9,16H2,1-3H3
InChIKeyCQARBOHNWRZLJW-UHFFFAOYSA-N
MW243.35 g/mol
LogP2.67
Rot. Bonds4

About [3-(2-methylpropyl)phenyl]-(2-methylpyrazol-3-yl)methanamine

[3-(2-methylpropyl)phenyl]-(2-methylpyrazol-3-yl)methanamine (PubChem CID 105188165) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is [3-(2-methylpropyl)phenyl]-(2-methylpyrazol-3-yl)methanamine.

Molecular Properties

Compound Name[3-(2-methylpropyl)phenyl]-(2-methylpyrazol-3-yl)methanamine
PubChem CID105188165
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC Name[3-(2-methylpropyl)phenyl]-(2-methylpyrazol-3-yl)methanamine
SMILESCC(C)Cc1cccc(C(N)c2ccnn2C)c1
InChIInChI=1S/C15H21N3/c1-11(2)9-12-5-4-6-13(10-12)15(16)14-7-8-17-18(14)3/h4-8,10-11,15H,9,16H2,1-3H3
InChIKeyCQARBOHNWRZLJW-UHFFFAOYSA-N
XLogP2.67
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [3-(2-methylpropyl)phenyl]-(2-methylpyrazol-3-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-chlorophenyl)-(2-methylpyrazol-3-yl)methanamine
CID 63963062
(1-methylimidazol-2-yl)-[3-(2-methylpropyl)phenyl]methanamine
CID 116544947
[3-(2-methylpropyl)phenyl]-(1,3,5-trimethylpyrazol-4-yl)methanamine
CID 105188108
[3-(2-methylpropyl)phenyl]-(5-methylpyrimidin-2-yl)methanamine
CID 116545007
1-[3-(2-methylpropyl)phenyl]-2-phenylethanamine
CID 116543879
(4-bromophenyl)-[3-(2-methylpropyl)phenyl]methanamine
CID 116543839
(3,5-difluorophenyl)-(2-methylpyrazol-3-yl)methanamine
CID 63963313
(2,6-dimethyl-4-pyridinyl)-(2-methylpyrazol-3-yl)methanamine
CID 107503143
(3,4-difluorophenyl)-[3-(2-methylpropyl)phenyl]methanamine
CID 116543886
(4-bromo-3,5-dimethylphenyl)-[3-(2-methylpropyl)phenyl]methanamine
CID 114330154
(4-methoxyphenyl)-[3-(2-methylpropyl)phenyl]methanamine
CID 116543817
[3-(2-methylpropyl)phenyl]-(thiadiazol-4-yl)methanamine
CID 105188049

Frequently Asked Questions

What is the IUPAC name of [3-(2-methylpropyl)phenyl]-(2-methylpyrazol-3-yl)methanamine?
The IUPAC name of [3-(2-methylpropyl)phenyl]-(2-methylpyrazol-3-yl)methanamine (CID 105188165) is [3-(2-methylpropyl)phenyl]-(2-methylpyrazol-3-yl)methanamine.
What is the SMILES notation for [3-(2-methylpropyl)phenyl]-(2-methylpyrazol-3-yl)methanamine?
The canonical SMILES for [3-(2-methylpropyl)phenyl]-(2-methylpyrazol-3-yl)methanamine is CC(C)Cc1cccc(C(N)c2ccnn2C)c1.
What is the InChIKey of [3-(2-methylpropyl)phenyl]-(2-methylpyrazol-3-yl)methanamine?
The InChIKey is CQARBOHNWRZLJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-11(2)9-12-5-4-6-13(10-12)15(16)14-7-8-17-18(14)3/h4-8,10-11,15H,9,16H2,1-3H3.
What are the key properties of [3-(2-methylpropyl)phenyl]-(2-methylpyrazol-3-yl)methanamine?
[3-(2-methylpropyl)phenyl]-(2-methylpyrazol-3-yl)methanamine has a molecular weight of 243.35 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-methylpropyl)phenyl]-(2-methylpyrazol-3-yl)methanamine is sourced from PubChem (CID 105188165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).