1-(1-ethoxycyclohexyl)-N-ethyl-2-(4-methyl-1,3-thiazol-2-yl)ethanamine

C16H28N2OS — CID 116764166

IUPAC1-(1-ethoxycyclohexyl)-N-ethyl-2-(4-methyl-1,3-thiazol-2-yl)ethanamine
SMILESCCNC(Cc1nc(C)cs1)C1(OCC)CCCCC1
InChIInChI=1S/C16H28N2OS/c1-4-17-14(11-15-18-13(3)12-20-15)16(19-5-2)9-7-6-8-10-16/h12,14,17H,4-11H2,1-3H3
InChIKeyWYUXELVVLMDXOF-UHFFFAOYSA-N
MW296.48 g/mol
LogP3.71
Rot. Bonds7

About 1-(1-ethoxycyclohexyl)-N-ethyl-2-(4-methyl-1,3-thiazol-2-yl)ethanamine

1-(1-ethoxycyclohexyl)-N-ethyl-2-(4-methyl-1,3-thiazol-2-yl)ethanamine (PubChem CID 116764166) has the molecular formula C16H28N2OS and a molecular weight of 296.48 g/mol. Its IUPAC name is 1-(1-ethoxycyclohexyl)-N-ethyl-2-(4-methyl-1,3-thiazol-2-yl)ethanamine.

Molecular Properties

Compound Name1-(1-ethoxycyclohexyl)-N-ethyl-2-(4-methyl-1,3-thiazol-2-yl)ethanamine
PubChem CID116764166
Molecular FormulaC16H28N2OS
Molecular Weight296.48 g/mol
Exact Mass296.19
IUPAC Name1-(1-ethoxycyclohexyl)-N-ethyl-2-(4-methyl-1,3-thiazol-2-yl)ethanamine
SMILESCCNC(Cc1nc(C)cs1)C1(OCC)CCCCC1
InChIInChI=1S/C16H28N2OS/c1-4-17-14(11-15-18-13(3)12-20-15)16(19-5-2)9-7-6-8-10-16/h12,14,17H,4-11H2,1-3H3
InChIKeyWYUXELVVLMDXOF-UHFFFAOYSA-N
XLogP3.71
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.48
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(1-ethoxycyclohexyl)-N-ethyl-2-(4-methyl-1,3-thiazol-2-yl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-ethyl-1-(1-methoxycyclopentyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine
CID 104611138
1-(1-ethoxy-3-methylcyclohexyl)-N-ethyl-2-(4-methyl-1,3-thiazol-2-yl)ethanamine
CID 116768464
N-ethyl-1-(4-methoxyoxan-4-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine
CID 116765085
2-(3-bromothiophen-2-yl)-1-(1-ethoxycyclopentyl)-N-ethylethanamine
CID 116762214
1-(1-ethoxycycloheptyl)-N-ethyl-2-thiophen-3-ylethanamine
CID 116771017
[1-(1-ethoxycyclohexyl)-2-(1,3-thiazol-2-yl)ethyl]hydrazine
CID 105276383
N-[1-(1-ethoxycyclopentyl)-2-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine
CID 116762382
2-(5-chlorothiophen-2-yl)-1-(1-ethoxycyclohexyl)-N-ethylethanamine
CID 116764052
1-(1-ethoxycyclohexyl)-N-methyl-2-(2-methyl-1,3-thiazol-4-yl)ethanamine
CID 116763827
1-(1-ethoxycyclohexyl)-N-ethyl-2-pyridin-3-ylethanamine
CID 116764064
1-(1-ethoxycyclopentyl)-N-ethyl-2-(3-methylphenyl)ethanamine
CID 116762276
1-(1-ethoxycyclohexyl)-N-ethyl-3-methylbutan-1-amine
CID 116764007

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethoxycyclohexyl)-N-ethyl-2-(4-methyl-1,3-thiazol-2-yl)ethanamine?
The IUPAC name of 1-(1-ethoxycyclohexyl)-N-ethyl-2-(4-methyl-1,3-thiazol-2-yl)ethanamine (CID 116764166) is 1-(1-ethoxycyclohexyl)-N-ethyl-2-(4-methyl-1,3-thiazol-2-yl)ethanamine.
What is the SMILES notation for 1-(1-ethoxycyclohexyl)-N-ethyl-2-(4-methyl-1,3-thiazol-2-yl)ethanamine?
The canonical SMILES for 1-(1-ethoxycyclohexyl)-N-ethyl-2-(4-methyl-1,3-thiazol-2-yl)ethanamine is CCNC(Cc1nc(C)cs1)C1(OCC)CCCCC1.
What is the InChIKey of 1-(1-ethoxycyclohexyl)-N-ethyl-2-(4-methyl-1,3-thiazol-2-yl)ethanamine?
The InChIKey is WYUXELVVLMDXOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2OS/c1-4-17-14(11-15-18-13(3)12-20-15)16(19-5-2)9-7-6-8-10-16/h12,14,17H,4-11H2,1-3H3.
What are the key properties of 1-(1-ethoxycyclohexyl)-N-ethyl-2-(4-methyl-1,3-thiazol-2-yl)ethanamine?
1-(1-ethoxycyclohexyl)-N-ethyl-2-(4-methyl-1,3-thiazol-2-yl)ethanamine has a molecular weight of 296.48 g/mol, XLogP of 3.71, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethoxycyclohexyl)-N-ethyl-2-(4-methyl-1,3-thiazol-2-yl)ethanamine is sourced from PubChem (CID 116764166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).