2-[3-(3-methylcyclopentyl)imidazol-4-yl]ethanamine

C11H19N3 — CID 114722524

IUPAC2-[3-(3-methylcyclopentyl)imidazol-4-yl]ethanamine
SMILESCC1CCC(n2cncc2CCN)C1
InChIInChI=1S/C11H19N3/c1-9-2-3-10(6-9)14-8-13-7-11(14)4-5-12/h7-10H,2-6,12H2,1H3
InChIKeyVTUWGQMMTFBHDN-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.75
Rot. Bonds3

About 2-[3-(3-methylcyclopentyl)imidazol-4-yl]ethanamine

2-[3-(3-methylcyclopentyl)imidazol-4-yl]ethanamine (PubChem CID 114722524) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-[3-(3-methylcyclopentyl)imidazol-4-yl]ethanamine.

Molecular Properties

Compound Name2-[3-(3-methylcyclopentyl)imidazol-4-yl]ethanamine
PubChem CID114722524
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name2-[3-(3-methylcyclopentyl)imidazol-4-yl]ethanamine
SMILESCC1CCC(n2cncc2CCN)C1
InChIInChI=1S/C11H19N3/c1-9-2-3-10(6-9)14-8-13-7-11(14)4-5-12/h7-10H,2-6,12H2,1H3
InChIKeyVTUWGQMMTFBHDN-UHFFFAOYSA-N
XLogP1.75
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-cyclobutylimidazol-4-yl)ethanamine
CID 83873401
2-(3-cyclooctylimidazol-4-yl)ethanamine
CID 114716513
2-[3-(thian-4-yl)imidazol-4-yl]ethanamine
CID 84734602
[3-(4-methylcyclohexyl)imidazol-4-yl]methanol
CID 66150398
2-[3-(1,1-dioxothian-3-yl)imidazol-4-yl]ethanamine
CID 114720388
(1R)-1-[3-(3-methylcyclopentyl)imidazol-4-yl]ethanamine
CID 104943974
(1S)-1-[3-(3-methylcyclopentyl)imidazol-4-yl]ethanamine
CID 104943969
2-(3-piperidin-3-ylimidazol-4-yl)ethanamine
CID 84733201
3-(3-cyclohexylimidazol-4-yl)propan-1-amine
CID 83883482
N-[(3-cyclopropylimidazol-4-yl)methyl]-1-(3-methylcyclopentyl)methanamine
CID 107412322
N-[(3-cyclopropylimidazol-4-yl)methyl]-3-methylcyclohexan-1-amine
CID 66164873
2-methyl-N-[[3-(3-methylcyclohexyl)imidazol-4-yl]methyl]propan-2-amine
CID 66146727

Frequently Asked Questions

What is the IUPAC name of 2-[3-(3-methylcyclopentyl)imidazol-4-yl]ethanamine?
The IUPAC name of 2-[3-(3-methylcyclopentyl)imidazol-4-yl]ethanamine (CID 114722524) is 2-[3-(3-methylcyclopentyl)imidazol-4-yl]ethanamine.
What is the SMILES notation for 2-[3-(3-methylcyclopentyl)imidazol-4-yl]ethanamine?
The canonical SMILES for 2-[3-(3-methylcyclopentyl)imidazol-4-yl]ethanamine is CC1CCC(n2cncc2CCN)C1.
What is the InChIKey of 2-[3-(3-methylcyclopentyl)imidazol-4-yl]ethanamine?
The InChIKey is VTUWGQMMTFBHDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-9-2-3-10(6-9)14-8-13-7-11(14)4-5-12/h7-10H,2-6,12H2,1H3.
What are the key properties of 2-[3-(3-methylcyclopentyl)imidazol-4-yl]ethanamine?
2-[3-(3-methylcyclopentyl)imidazol-4-yl]ethanamine has a molecular weight of 193.29 g/mol, XLogP of 1.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(3-methylcyclopentyl)imidazol-4-yl]ethanamine is sourced from PubChem (CID 114722524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).