1-[2-(1-ethylimidazol-2-yl)-1-(methylamino)ethyl]-N,N,3-trimethylcyclohexan-1-amine

C17H32N4 — CID 79752550

IUPAC1-[2-(1-ethylimidazol-2-yl)-1-(methylamino)ethyl]-N,N,3-trimethylcyclohexan-1-amine
SMILESCCn1ccnc1CC(NC)C1(N(C)C)CCCC(C)C1
InChIInChI=1S/C17H32N4/c1-6-21-11-10-19-16(21)12-15(18-3)17(20(4)5)9-7-8-14(2)13-17/h10-11,14-15,18H,6-9,12-13H2,1-5H3
InChIKeyMQIXTGCHQQFSGL-UHFFFAOYSA-N
MW292.47 g/mol
LogP2.54
Rot. Bonds6

About 1-[2-(1-ethylimidazol-2-yl)-1-(methylamino)ethyl]-N,N,3-trimethylcyclohexan-1-amine

1-[2-(1-ethylimidazol-2-yl)-1-(methylamino)ethyl]-N,N,3-trimethylcyclohexan-1-amine (PubChem CID 79752550) has the molecular formula C17H32N4 and a molecular weight of 292.47 g/mol. Its IUPAC name is 1-[2-(1-ethylimidazol-2-yl)-1-(methylamino)ethyl]-N,N,3-trimethylcyclohexan-1-amine.

Molecular Properties

Compound Name1-[2-(1-ethylimidazol-2-yl)-1-(methylamino)ethyl]-N,N,3-trimethylcyclohexan-1-amine
PubChem CID79752550
Molecular FormulaC17H32N4
Molecular Weight292.47 g/mol
Exact Mass292.26
IUPAC Name1-[2-(1-ethylimidazol-2-yl)-1-(methylamino)ethyl]-N,N,3-trimethylcyclohexan-1-amine
SMILESCCn1ccnc1CC(NC)C1(N(C)C)CCCC(C)C1
InChIInChI=1S/C17H32N4/c1-6-21-11-10-19-16(21)12-15(18-3)17(20(4)5)9-7-8-14(2)13-17/h10-11,14-15,18H,6-9,12-13H2,1-5H3
InChIKeyMQIXTGCHQQFSGL-UHFFFAOYSA-N
XLogP2.54
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.47
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-ethoxy-4-methylcyclohexyl)-2-(1-ethylimidazol-2-yl)-N-methylethanamine
CID 116767193
1-[1-(dimethylamino)cyclopentyl]-2-(1-ethylimidazol-2-yl)ethanol
CID 79752032
1-[2-(5-bromo-2-pyridinyl)-1-(methylamino)ethyl]-N,N,3-trimethylcyclohexan-1-amine
CID 104803076
1-[2-(4-chlorophenyl)-1-(methylamino)ethyl]-N,N,3-trimethylcyclohexan-1-amine
CID 79062833
[1-[(1-ethylimidazol-2-yl)methylamino]-3-methylcyclohexyl]methanol
CID 62552492
N,N,3-trimethyl-1-[1-(methylamino)but-3-ynyl]cyclohexan-1-amine
CID 79074998
[2-(1-ethylimidazol-2-yl)-1-(1-methylcyclopentyl)ethyl]hydrazine
CID 105321806
1-[1-(ethylamino)-2-(1-propylimidazol-2-yl)ethyl]-N,N-dimethylcyclopentan-1-amine
CID 79751938
N,N,3-trimethyl-1-[1-(methylamino)-3-(1-methylpyrazol-4-yl)propyl]cyclohexan-1-amine
CID 103011187
[2-(1-ethylimidazol-2-yl)-1-(1-methylcyclohexyl)ethyl]hydrazine
CID 106831292
N,N,4-trimethyl-1-[methylamino-(1-propylimidazol-2-yl)methyl]cyclohexan-1-amine
CID 79061796
1-[3-ethyl-1-(methylamino)heptyl]-N,N,3-trimethylcyclohexan-1-amine
CID 79063346

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1-ethylimidazol-2-yl)-1-(methylamino)ethyl]-N,N,3-trimethylcyclohexan-1-amine?
The IUPAC name of 1-[2-(1-ethylimidazol-2-yl)-1-(methylamino)ethyl]-N,N,3-trimethylcyclohexan-1-amine (CID 79752550) is 1-[2-(1-ethylimidazol-2-yl)-1-(methylamino)ethyl]-N,N,3-trimethylcyclohexan-1-amine.
What is the SMILES notation for 1-[2-(1-ethylimidazol-2-yl)-1-(methylamino)ethyl]-N,N,3-trimethylcyclohexan-1-amine?
The canonical SMILES for 1-[2-(1-ethylimidazol-2-yl)-1-(methylamino)ethyl]-N,N,3-trimethylcyclohexan-1-amine is CCn1ccnc1CC(NC)C1(N(C)C)CCCC(C)C1.
What is the InChIKey of 1-[2-(1-ethylimidazol-2-yl)-1-(methylamino)ethyl]-N,N,3-trimethylcyclohexan-1-amine?
The InChIKey is MQIXTGCHQQFSGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N4/c1-6-21-11-10-19-16(21)12-15(18-3)17(20(4)5)9-7-8-14(2)13-17/h10-11,14-15,18H,6-9,12-13H2,1-5H3.
What are the key properties of 1-[2-(1-ethylimidazol-2-yl)-1-(methylamino)ethyl]-N,N,3-trimethylcyclohexan-1-amine?
1-[2-(1-ethylimidazol-2-yl)-1-(methylamino)ethyl]-N,N,3-trimethylcyclohexan-1-amine has a molecular weight of 292.47 g/mol, XLogP of 2.54, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1-ethylimidazol-2-yl)-1-(methylamino)ethyl]-N,N,3-trimethylcyclohexan-1-amine is sourced from PubChem (CID 79752550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).