2-cyclohexyl-1-(2-methylpyrazol-3-yl)ethanamine

C12H21N3 — CID 115858431

IUPAC2-cyclohexyl-1-(2-methylpyrazol-3-yl)ethanamine
SMILESCn1nccc1C(N)CC1CCCCC1
InChIInChI=1S/C12H21N3/c1-15-12(7-8-14-15)11(13)9-10-5-3-2-4-6-10/h7-8,10-11H,2-6,9,13H2,1H3
InChIKeyIOTGRNFFVDRRCG-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.39
Rot. Bonds3

About 2-cyclohexyl-1-(2-methylpyrazol-3-yl)ethanamine

2-cyclohexyl-1-(2-methylpyrazol-3-yl)ethanamine (PubChem CID 115858431) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 2-cyclohexyl-1-(2-methylpyrazol-3-yl)ethanamine.

Molecular Properties

Compound Name2-cyclohexyl-1-(2-methylpyrazol-3-yl)ethanamine
PubChem CID115858431
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name2-cyclohexyl-1-(2-methylpyrazol-3-yl)ethanamine
SMILESCn1nccc1C(N)CC1CCCCC1
InChIInChI=1S/C12H21N3/c1-15-12(7-8-14-15)11(13)9-10-5-3-2-4-6-10/h7-8,10-11H,2-6,9,13H2,1H3
InChIKeyIOTGRNFFVDRRCG-UHFFFAOYSA-N
XLogP2.39
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-cyclohexyl-1-(2-methylpyrazol-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-(3,3-difluorocyclohexyl)-1-(2-methylpyrazol-3-yl)ethanamine
CID 114225872
2-cyclopentyl-1-(2-methylpyrazol-3-yl)ethanol
CID 114554130
1-(2-methylpyrazol-3-yl)-2-(1-methylsulfonylpiperidin-3-yl)ethanamine
CID 105167008
2-(1,1-dioxothiolan-3-yl)-1-(2-methylpyrazol-3-yl)ethanamine
CID 105148582
2-cyclopentyl-N-methyl-1-(2-methylpyrazol-3-yl)ethanamine
CID 115858828
[cyclopentyl-(2-methylpyrazol-3-yl)methyl]hydrazine
CID 105204250
N-(cyclohexylmethyl)-1-(2-methylpyrazol-3-yl)ethanamine
CID 106757054
2-cyclohexyl-1-(3-methylimidazol-4-yl)ethanamine
CID 82895962
2-cyclohexyl-2-methoxy-1-(2-methylpyrazol-3-yl)ethanamine
CID 116771231
2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-(2-methylpyrazol-3-yl)ethanamine
CID 105162867
2-cyclopropyl-2-(2-methylpyrazol-3-yl)ethanamine
CID 83826852
cyclooctyl-(2-ethylpyrazol-3-yl)methanamine
CID 80604016

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1-(2-methylpyrazol-3-yl)ethanamine?
The IUPAC name of 2-cyclohexyl-1-(2-methylpyrazol-3-yl)ethanamine (CID 115858431) is 2-cyclohexyl-1-(2-methylpyrazol-3-yl)ethanamine.
What is the SMILES notation for 2-cyclohexyl-1-(2-methylpyrazol-3-yl)ethanamine?
The canonical SMILES for 2-cyclohexyl-1-(2-methylpyrazol-3-yl)ethanamine is Cn1nccc1C(N)CC1CCCCC1.
What is the InChIKey of 2-cyclohexyl-1-(2-methylpyrazol-3-yl)ethanamine?
The InChIKey is IOTGRNFFVDRRCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-15-12(7-8-14-15)11(13)9-10-5-3-2-4-6-10/h7-8,10-11H,2-6,9,13H2,1H3.
What are the key properties of 2-cyclohexyl-1-(2-methylpyrazol-3-yl)ethanamine?
2-cyclohexyl-1-(2-methylpyrazol-3-yl)ethanamine has a molecular weight of 207.32 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1-(2-methylpyrazol-3-yl)ethanamine is sourced from PubChem (CID 115858431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).