1-(4-propylcyclohexyl)-2-(1-propylimidazol-2-yl)ethanamine

C17H31N3 — CID 79761510

IUPAC1-(4-propylcyclohexyl)-2-(1-propylimidazol-2-yl)ethanamine
SMILESCCCC1CCC(C(N)Cc2nccn2CCC)CC1
InChIInChI=1S/C17H31N3/c1-3-5-14-6-8-15(9-7-14)16(18)13-17-19-10-12-20(17)11-4-2/h10,12,14-16H,3-9,11,13,18H2,1-2H3
InChIKeyZZGBXAHEKPBJOA-UHFFFAOYSA-N
MW277.46 g/mol
LogP3.77
Rot. Bonds7

About 1-(4-propylcyclohexyl)-2-(1-propylimidazol-2-yl)ethanamine

1-(4-propylcyclohexyl)-2-(1-propylimidazol-2-yl)ethanamine (PubChem CID 79761510) has the molecular formula C17H31N3 and a molecular weight of 277.46 g/mol. Its IUPAC name is 1-(4-propylcyclohexyl)-2-(1-propylimidazol-2-yl)ethanamine.

Molecular Properties

Compound Name1-(4-propylcyclohexyl)-2-(1-propylimidazol-2-yl)ethanamine
PubChem CID79761510
Molecular FormulaC17H31N3
Molecular Weight277.46 g/mol
Exact Mass277.25
IUPAC Name1-(4-propylcyclohexyl)-2-(1-propylimidazol-2-yl)ethanamine
SMILESCCCC1CCC(C(N)Cc2nccn2CCC)CC1
InChIInChI=1S/C17H31N3/c1-3-5-14-6-8-15(9-7-14)16(18)13-17-19-10-12-20(17)11-4-2/h10,12,14-16H,3-9,11,13,18H2,1-2H3
InChIKeyZZGBXAHEKPBJOA-UHFFFAOYSA-N
XLogP3.77
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.46
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-ethylimidazol-2-yl)-1-(4-propylcyclohexyl)ethanamine
CID 79761385
2-(1-methylimidazol-2-yl)-1-(4-propylcyclohexyl)ethanamine
CID 79761258
2-(1-ethylimidazol-2-yl)-1-(4-propylcyclohexyl)ethanol
CID 79752753
1-(2-methylcyclopentyl)-2-(1-propylimidazol-2-yl)ethanamine
CID 107189999
2-(1-propylimidazol-2-yl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine
CID 105012449
2-(1-ethylimidazol-2-yl)-1-(oxan-4-yl)ethanamine
CID 79761126
1-(2,2-dimethylcyclohexyl)-2-(1-propylimidazol-2-yl)ethanamine
CID 107189998
(1-methylimidazol-2-yl)-(4-propylcyclohexyl)methanamine
CID 65423372
4-cyclopentyl-N-propyl-1-(1-propylimidazol-2-yl)butan-2-amine
CID 105012343
4-cyclohexyl-N-ethyl-1-(1-propylimidazol-2-yl)butan-2-amine
CID 105012509
2-cyclopentyl-1-(1-propylimidazol-2-yl)ethanamine
CID 115858989
2-(4-chloro-4-cyclopropylbutyl)-1-propylimidazole
CID 79760428

Frequently Asked Questions

What is the IUPAC name of 1-(4-propylcyclohexyl)-2-(1-propylimidazol-2-yl)ethanamine?
The IUPAC name of 1-(4-propylcyclohexyl)-2-(1-propylimidazol-2-yl)ethanamine (CID 79761510) is 1-(4-propylcyclohexyl)-2-(1-propylimidazol-2-yl)ethanamine.
What is the SMILES notation for 1-(4-propylcyclohexyl)-2-(1-propylimidazol-2-yl)ethanamine?
The canonical SMILES for 1-(4-propylcyclohexyl)-2-(1-propylimidazol-2-yl)ethanamine is CCCC1CCC(C(N)Cc2nccn2CCC)CC1.
What is the InChIKey of 1-(4-propylcyclohexyl)-2-(1-propylimidazol-2-yl)ethanamine?
The InChIKey is ZZGBXAHEKPBJOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31N3/c1-3-5-14-6-8-15(9-7-14)16(18)13-17-19-10-12-20(17)11-4-2/h10,12,14-16H,3-9,11,13,18H2,1-2H3.
What are the key properties of 1-(4-propylcyclohexyl)-2-(1-propylimidazol-2-yl)ethanamine?
1-(4-propylcyclohexyl)-2-(1-propylimidazol-2-yl)ethanamine has a molecular weight of 277.46 g/mol, XLogP of 3.77, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-propylcyclohexyl)-2-(1-propylimidazol-2-yl)ethanamine is sourced from PubChem (CID 79761510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).