2-(1-cyclohexylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylethanamine

C17H24N4 — CID 64786076

IUPAC2-(1-cyclohexylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylethanamine
SMILESCNC(Cc1ccn(C2CCCCC2)n1)c1cccnc1
InChIInChI=1S/C17H24N4/c1-18-17(14-6-5-10-19-13-14)12-15-9-11-21(20-15)16-7-3-2-4-8-16/h5-6,9-11,13,16-18H,2-4,7-8,12H2,1H3
InChIKeyIIAOCBIOFSOKDK-UHFFFAOYSA-N
MW284.41 g/mol
LogP3.29
Rot. Bonds5

About 2-(1-cyclohexylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylethanamine

2-(1-cyclohexylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylethanamine (PubChem CID 64786076) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is 2-(1-cyclohexylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylethanamine.

Molecular Properties

Compound Name2-(1-cyclohexylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylethanamine
PubChem CID64786076
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC Name2-(1-cyclohexylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylethanamine
SMILESCNC(Cc1ccn(C2CCCCC2)n1)c1cccnc1
InChIInChI=1S/C17H24N4/c1-18-17(14-6-5-10-19-13-14)12-15-9-11-21(20-15)16-7-3-2-4-8-16/h5-6,9-11,13,16-18H,2-4,7-8,12H2,1H3
InChIKeyIIAOCBIOFSOKDK-UHFFFAOYSA-N
XLogP3.29
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-cyclopentylpyrazol-3-yl)-N-methyl-1-phenylethanamine
CID 64777224
2-(1-cyclopentylpyrazol-3-yl)-N-methyl-1-(6-methyl-3-pyridinyl)ethanamine
CID 105157078
2-(1-cyclopentylpyrazol-3-yl)-1-(4-fluorophenyl)-N-methylethanamine
CID 64785855
N-[(1-cyclopentylpyrazol-3-yl)methyl]-1-pyridin-3-ylethanamine
CID 64799108
2-(1-cyclohexylpyrazol-3-yl)-N-methyl-1-(1-methylimidazol-4-yl)ethanamine
CID 107975620
3-(1-cyclohexylpyrazol-3-yl)-1,1-difluoro-N-methylpropan-2-amine
CID 103516696
2-(1-cyclohexylpyrazol-3-yl)-1-pyrimidin-5-ylethanamine
CID 102923483
2-(1-cyclopentylpyrazol-3-yl)-N-ethyl-1-pyrimidin-2-ylethanamine
CID 64778210
2-(1-cyclopentylpyrazol-3-yl)-N-methyl-1-(2-methyl-1,3-thiazol-4-yl)ethanamine
CID 105157013
[2-(1-cyclopentylpyrazol-3-yl)-1-pyrimidin-2-ylethyl]hydrazine
CID 105203635
1-(1-cyclohexylpyrazol-3-yl)-3-pyridin-3-ylpropan-2-one
CID 64783174
1-(1-cyclopentylpyrazol-3-yl)-N,4-dimethylpentan-2-amine
CID 64784145

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclohexylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylethanamine?
The IUPAC name of 2-(1-cyclohexylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylethanamine (CID 64786076) is 2-(1-cyclohexylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylethanamine.
What is the SMILES notation for 2-(1-cyclohexylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylethanamine?
The canonical SMILES for 2-(1-cyclohexylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylethanamine is CNC(Cc1ccn(C2CCCCC2)n1)c1cccnc1.
What is the InChIKey of 2-(1-cyclohexylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylethanamine?
The InChIKey is IIAOCBIOFSOKDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4/c1-18-17(14-6-5-10-19-13-14)12-15-9-11-21(20-15)16-7-3-2-4-8-16/h5-6,9-11,13,16-18H,2-4,7-8,12H2,1H3.
What are the key properties of 2-(1-cyclohexylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylethanamine?
2-(1-cyclohexylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylethanamine has a molecular weight of 284.41 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclohexylpyrazol-3-yl)-N-methyl-1-pyridin-3-ylethanamine is sourced from PubChem (CID 64786076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).