4-cyclopentyl-1-(1-ethylimidazol-2-yl)butan-2-amine

C14H25N3 — CID 105009415

IUPAC4-cyclopentyl-1-(1-ethylimidazol-2-yl)butan-2-amine
SMILESCCn1ccnc1CC(N)CCC1CCCC1
InChIInChI=1S/C14H25N3/c1-2-17-10-9-16-14(17)11-13(15)8-7-12-5-3-4-6-12/h9-10,12-13H,2-8,11,15H2,1H3
InChIKeyAVWLWOBYSASZGO-UHFFFAOYSA-N
MW235.38 g/mol
LogP2.74
Rot. Bonds6

About 4-cyclopentyl-1-(1-ethylimidazol-2-yl)butan-2-amine

4-cyclopentyl-1-(1-ethylimidazol-2-yl)butan-2-amine (PubChem CID 105009415) has the molecular formula C14H25N3 and a molecular weight of 235.38 g/mol. Its IUPAC name is 4-cyclopentyl-1-(1-ethylimidazol-2-yl)butan-2-amine.

Molecular Properties

Compound Name4-cyclopentyl-1-(1-ethylimidazol-2-yl)butan-2-amine
PubChem CID105009415
Molecular FormulaC14H25N3
Molecular Weight235.38 g/mol
Exact Mass235.20
IUPAC Name4-cyclopentyl-1-(1-ethylimidazol-2-yl)butan-2-amine
SMILESCCn1ccnc1CC(N)CCC1CCCC1
InChIInChI=1S/C14H25N3/c1-2-17-10-9-16-14(17)11-13(15)8-7-12-5-3-4-6-12/h9-10,12-13H,2-8,11,15H2,1H3
InChIKeyAVWLWOBYSASZGO-UHFFFAOYSA-N
XLogP2.74
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.38
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-cyclohexyl-1-(1-methylimidazol-2-yl)butan-2-amine
CID 115580373
1-(1-ethylimidazol-2-yl)undecan-2-amine
CID 105009322
2-(1-ethylimidazol-2-yl)-1-(4-propylcyclohexyl)ethanamine
CID 79761385
2-(1-ethylimidazol-2-yl)-1-(4-propylcyclohexyl)ethanol
CID 79752753
[1-cycloheptyl-2-(1-ethylimidazol-2-yl)ethyl]hydrazine
CID 105232129
1-(1-ethylimidazol-2-yl)-4-phenylbutan-2-amine
CID 79751475
4-cyclopentyl-1-(2-propyl-1,2,4-triazol-3-yl)butan-2-amine
CID 105003205
(2R)-1-(1-ethylimidazol-2-yl)propan-2-amine
CID 92763393
1-(4-butylcyclohexyl)-2-(1-ethylimidazol-2-yl)ethanol
CID 115819272
2-cyclohexyl-N-[(1-ethylimidazol-2-yl)methyl]ethanamine
CID 55064443
2-(1-ethylimidazol-2-yl)-1-(oxan-4-yl)ethanamine
CID 79761126
4-cyclopentyl-N-propyl-1-(1-propylimidazol-2-yl)butan-2-amine
CID 105012343

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-1-(1-ethylimidazol-2-yl)butan-2-amine?
The IUPAC name of 4-cyclopentyl-1-(1-ethylimidazol-2-yl)butan-2-amine (CID 105009415) is 4-cyclopentyl-1-(1-ethylimidazol-2-yl)butan-2-amine.
What is the SMILES notation for 4-cyclopentyl-1-(1-ethylimidazol-2-yl)butan-2-amine?
The canonical SMILES for 4-cyclopentyl-1-(1-ethylimidazol-2-yl)butan-2-amine is CCn1ccnc1CC(N)CCC1CCCC1.
What is the InChIKey of 4-cyclopentyl-1-(1-ethylimidazol-2-yl)butan-2-amine?
The InChIKey is AVWLWOBYSASZGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-2-17-10-9-16-14(17)11-13(15)8-7-12-5-3-4-6-12/h9-10,12-13H,2-8,11,15H2,1H3.
What are the key properties of 4-cyclopentyl-1-(1-ethylimidazol-2-yl)butan-2-amine?
4-cyclopentyl-1-(1-ethylimidazol-2-yl)butan-2-amine has a molecular weight of 235.38 g/mol, XLogP of 2.74, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-1-(1-ethylimidazol-2-yl)butan-2-amine is sourced from PubChem (CID 105009415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).