2-(1-ethylimidazol-2-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine

C17H23N3 — CID 79760621

IUPAC2-(1-ethylimidazol-2-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
SMILESCCn1ccnc1CC(N)C1CCc2ccccc2C1
InChIInChI=1S/C17H23N3/c1-2-20-10-9-19-17(20)12-16(18)15-8-7-13-5-3-4-6-14(13)11-15/h3-6,9-10,15-16H,2,7-8,11-12,18H2,1H3
InChIKeyWBMQYZZRTJNGOL-UHFFFAOYSA-N
MW269.39 g/mol
LogP2.58
Rot. Bonds4

About 2-(1-ethylimidazol-2-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine

2-(1-ethylimidazol-2-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine (PubChem CID 79760621) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is 2-(1-ethylimidazol-2-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine.

Molecular Properties

Compound Name2-(1-ethylimidazol-2-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
PubChem CID79760621
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC Name2-(1-ethylimidazol-2-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
SMILESCCn1ccnc1CC(N)C1CCc2ccccc2C1
InChIInChI=1S/C17H23N3/c1-2-20-10-9-19-17(20)12-16(18)15-8-7-13-5-3-4-6-14(13)11-15/h3-6,9-10,15-16H,2,7-8,11-12,18H2,1H3
InChIKeyWBMQYZZRTJNGOL-UHFFFAOYSA-N
XLogP2.58
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-ethylimidazol-2-yl)-1-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
CID 79751984
2-(1-ethylimidazol-2-yl)-1-(oxan-4-yl)ethanamine
CID 79761126
2-(1-ethylimidazol-2-yl)-1-(4-propylcyclohexyl)ethanamine
CID 79761385
2-phenyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
CID 65404384
2-(1-ethylimidazol-2-yl)-1-(5-methyloxolan-3-yl)ethanamine
CID 105009554
1-(3,4-dihydro-2H-chromen-3-yl)-2-(1-ethylimidazol-2-yl)ethanol
CID 79752635
2-(4-methylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
CID 65404581
1-(2,2-dimethylcyclopropyl)-2-(1-ethylimidazol-2-yl)ethanamine
CID 107004731
2-pyridin-3-yl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
CID 104736415
1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethane-1,2-diamine
CID 91218484
2-(2-methyltetrazol-5-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
CID 107049596
1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-2-(1-ethylimidazol-2-yl)ethanol
CID 79752863

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylimidazol-2-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine?
The IUPAC name of 2-(1-ethylimidazol-2-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine (CID 79760621) is 2-(1-ethylimidazol-2-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine.
What is the SMILES notation for 2-(1-ethylimidazol-2-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine?
The canonical SMILES for 2-(1-ethylimidazol-2-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine is CCn1ccnc1CC(N)C1CCc2ccccc2C1.
What is the InChIKey of 2-(1-ethylimidazol-2-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine?
The InChIKey is WBMQYZZRTJNGOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-2-20-10-9-19-17(20)12-16(18)15-8-7-13-5-3-4-6-14(13)11-15/h3-6,9-10,15-16H,2,7-8,11-12,18H2,1H3.
What are the key properties of 2-(1-ethylimidazol-2-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine?
2-(1-ethylimidazol-2-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine has a molecular weight of 269.39 g/mol, XLogP of 2.58, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylimidazol-2-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine is sourced from PubChem (CID 79760621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).