2-(1-ethylpyrazol-4-yl)-1-(1-methylcyclohexyl)ethanamine

C14H25N3 — CID 106829887

IUPAC2-(1-ethylpyrazol-4-yl)-1-(1-methylcyclohexyl)ethanamine
SMILESCCn1cc(CC(N)C2(C)CCCCC2)cn1
InChIInChI=1S/C14H25N3/c1-3-17-11-12(10-16-17)9-13(15)14(2)7-5-4-6-8-14/h10-11,13H,3-9,15H2,1-2H3
InChIKeyIOXRPUAUTJGNBG-UHFFFAOYSA-N
MW235.37 g/mol
LogP2.74
Rot. Bonds4

About 2-(1-ethylpyrazol-4-yl)-1-(1-methylcyclohexyl)ethanamine

2-(1-ethylpyrazol-4-yl)-1-(1-methylcyclohexyl)ethanamine (PubChem CID 106829887) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is 2-(1-ethylpyrazol-4-yl)-1-(1-methylcyclohexyl)ethanamine.

Molecular Properties

Compound Name2-(1-ethylpyrazol-4-yl)-1-(1-methylcyclohexyl)ethanamine
PubChem CID106829887
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC Name2-(1-ethylpyrazol-4-yl)-1-(1-methylcyclohexyl)ethanamine
SMILESCCn1cc(CC(N)C2(C)CCCCC2)cn1
InChIInChI=1S/C14H25N3/c1-3-17-11-12(10-16-17)9-13(15)14(2)7-5-4-6-8-14/h10-11,13H,3-9,15H2,1-2H3
InChIKeyIOXRPUAUTJGNBG-UHFFFAOYSA-N
XLogP2.74
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-ethylpyrazol-4-yl)-1-(1-methylcyclopentyl)ethanamine
CID 115822094
2-(1-ethylpyrazol-4-yl)-N-methyl-1-(1-methylcyclopentyl)ethanamine
CID 115822926
1-(2,2-dimethylcyclopropyl)-2-(1-ethylpyrazol-4-yl)ethanamine
CID 107004225
1-[(1-ethylpyrazol-4-yl)methyl]-4,4-dimethylcycloheptan-1-amine
CID 65083823
2-amino-3-(1-ethylpyrazol-4-yl)propan-1-ol
CID 64571799
2-(1-ethylpyrazol-4-yl)-1-pyrimidin-2-ylethanamine
CID 62126098
1-(1-ethylpyrazol-4-yl)-N-[(1-methylcyclohexyl)methyl]methanamine
CID 103753080
1-(1-methylcyclopentyl)-3-(1-methylpyrazol-4-yl)propan-1-amine
CID 103029892
1-(4-ethylcyclohexyl)-2-(1-ethylpyrazol-4-yl)ethanamine
CID 65392490
2-[(1-ethylpyrazol-4-yl)methyl]butan-1-amine
CID 62505904
N-[1-(1-ethylcyclopentyl)-2-(1-ethylpyrazol-4-yl)ethyl]propan-1-amine
CID 115822846
1-(3-bicyclo[3.1.0]hexanyl)-2-(1-ethylpyrazol-4-yl)ethanamine
CID 115822637

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylpyrazol-4-yl)-1-(1-methylcyclohexyl)ethanamine?
The IUPAC name of 2-(1-ethylpyrazol-4-yl)-1-(1-methylcyclohexyl)ethanamine (CID 106829887) is 2-(1-ethylpyrazol-4-yl)-1-(1-methylcyclohexyl)ethanamine.
What is the SMILES notation for 2-(1-ethylpyrazol-4-yl)-1-(1-methylcyclohexyl)ethanamine?
The canonical SMILES for 2-(1-ethylpyrazol-4-yl)-1-(1-methylcyclohexyl)ethanamine is CCn1cc(CC(N)C2(C)CCCCC2)cn1.
What is the InChIKey of 2-(1-ethylpyrazol-4-yl)-1-(1-methylcyclohexyl)ethanamine?
The InChIKey is IOXRPUAUTJGNBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-3-17-11-12(10-16-17)9-13(15)14(2)7-5-4-6-8-14/h10-11,13H,3-9,15H2,1-2H3.
What are the key properties of 2-(1-ethylpyrazol-4-yl)-1-(1-methylcyclohexyl)ethanamine?
2-(1-ethylpyrazol-4-yl)-1-(1-methylcyclohexyl)ethanamine has a molecular weight of 235.37 g/mol, XLogP of 2.74, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylpyrazol-4-yl)-1-(1-methylcyclohexyl)ethanamine is sourced from PubChem (CID 106829887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).