1-(3-ethylcyclohexyl)-N-methyl-2-(1-methylimidazol-2-yl)ethanamine

C15H27N3 — CID 79761386

IUPAC1-(3-ethylcyclohexyl)-N-methyl-2-(1-methylimidazol-2-yl)ethanamine
SMILESCCC1CCCC(C(Cc2nccn2C)NC)C1
InChIInChI=1S/C15H27N3/c1-4-12-6-5-7-13(10-12)14(16-2)11-15-17-8-9-18(15)3/h8-9,12-14,16H,4-7,10-11H2,1-3H3
InChIKeyOZLKDJYYEPCHPN-UHFFFAOYSA-N
MW249.40 g/mol
LogP2.77
Rot. Bonds5

About 1-(3-ethylcyclohexyl)-N-methyl-2-(1-methylimidazol-2-yl)ethanamine

1-(3-ethylcyclohexyl)-N-methyl-2-(1-methylimidazol-2-yl)ethanamine (PubChem CID 79761386) has the molecular formula C15H27N3 and a molecular weight of 249.40 g/mol. Its IUPAC name is 1-(3-ethylcyclohexyl)-N-methyl-2-(1-methylimidazol-2-yl)ethanamine.

Molecular Properties

Compound Name1-(3-ethylcyclohexyl)-N-methyl-2-(1-methylimidazol-2-yl)ethanamine
PubChem CID79761386
Molecular FormulaC15H27N3
Molecular Weight249.40 g/mol
Exact Mass249.22
IUPAC Name1-(3-ethylcyclohexyl)-N-methyl-2-(1-methylimidazol-2-yl)ethanamine
SMILESCCC1CCCC(C(Cc2nccn2C)NC)C1
InChIInChI=1S/C15H27N3/c1-4-12-6-5-7-13(10-12)14(16-2)11-15-17-8-9-18(15)3/h8-9,12-14,16H,4-7,10-11H2,1-3H3
InChIKeyOZLKDJYYEPCHPN-UHFFFAOYSA-N
XLogP2.77
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopropyl-N-methyl-2-(1-methylimidazol-2-yl)ethanamine
CID 63352794
N-methyl-1-(3-methylcyclopentyl)-2-(1-methylimidazol-2-yl)ethanamine
CID 79762232
N-methyl-1-(4-methylcyclohexyl)-2-(1-methylimidazol-2-yl)ethanamine
CID 79752220
1-cyclopentyl-N-methyl-3-(1-methylimidazol-2-yl)propan-2-amine
CID 105011635
1-cyclobutyl-N-methyl-2-(1-propylimidazol-2-yl)ethanamine
CID 79760970
1-cyclobutyl-N-methyl-3-(1-methylimidazol-2-yl)propan-1-amine
CID 114530243
(3-ethylcyclohexyl)-(1-methylimidazol-2-yl)methanol
CID 65400333
N-methyl-2-(1-methylimidazol-2-yl)-1-(thiolan-2-yl)ethanamine
CID 80622951
1-(2,2-dimethylcyclohexyl)-N-methyl-2-(1-methylimidazol-2-yl)ethanamine
CID 107189965
N-ethyl-1-(3-ethylcyclopentyl)-2-(1-ethylimidazol-2-yl)ethanamine
CID 79761771
N-methyl-1-(3-methylcyclopentyl)-2-(1-propylimidazol-2-yl)ethanamine
CID 79762352
1-cyclobutyl-3-(1-methylimidazol-2-yl)propan-2-ol
CID 103170139

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethylcyclohexyl)-N-methyl-2-(1-methylimidazol-2-yl)ethanamine?
The IUPAC name of 1-(3-ethylcyclohexyl)-N-methyl-2-(1-methylimidazol-2-yl)ethanamine (CID 79761386) is 1-(3-ethylcyclohexyl)-N-methyl-2-(1-methylimidazol-2-yl)ethanamine.
What is the SMILES notation for 1-(3-ethylcyclohexyl)-N-methyl-2-(1-methylimidazol-2-yl)ethanamine?
The canonical SMILES for 1-(3-ethylcyclohexyl)-N-methyl-2-(1-methylimidazol-2-yl)ethanamine is CCC1CCCC(C(Cc2nccn2C)NC)C1.
What is the InChIKey of 1-(3-ethylcyclohexyl)-N-methyl-2-(1-methylimidazol-2-yl)ethanamine?
The InChIKey is OZLKDJYYEPCHPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3/c1-4-12-6-5-7-13(10-12)14(16-2)11-15-17-8-9-18(15)3/h8-9,12-14,16H,4-7,10-11H2,1-3H3.
What are the key properties of 1-(3-ethylcyclohexyl)-N-methyl-2-(1-methylimidazol-2-yl)ethanamine?
1-(3-ethylcyclohexyl)-N-methyl-2-(1-methylimidazol-2-yl)ethanamine has a molecular weight of 249.40 g/mol, XLogP of 2.77, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethylcyclohexyl)-N-methyl-2-(1-methylimidazol-2-yl)ethanamine is sourced from PubChem (CID 79761386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).