2-cyclohexyl-N-ethyl-2-methoxy-1-(5-methylthiophen-2-yl)ethanamine

C16H27NOS — CID 116771802

IUPAC2-cyclohexyl-N-ethyl-2-methoxy-1-(5-methylthiophen-2-yl)ethanamine
SMILESCCNC(c1ccc(C)s1)C(OC)C1CCCCC1
InChIInChI=1S/C16H27NOS/c1-4-17-15(14-11-10-12(2)19-14)16(18-3)13-8-6-5-7-9-13/h10-11,13,15-17H,4-9H2,1-3H3
InChIKeyNLVHYSQRAJRPSU-UHFFFAOYSA-N
MW281.46 g/mol
LogP4.30
Rot. Bonds6

About 2-cyclohexyl-N-ethyl-2-methoxy-1-(5-methylthiophen-2-yl)ethanamine

2-cyclohexyl-N-ethyl-2-methoxy-1-(5-methylthiophen-2-yl)ethanamine (PubChem CID 116771802) has the molecular formula C16H27NOS and a molecular weight of 281.46 g/mol. Its IUPAC name is 2-cyclohexyl-N-ethyl-2-methoxy-1-(5-methylthiophen-2-yl)ethanamine.

Molecular Properties

Compound Name2-cyclohexyl-N-ethyl-2-methoxy-1-(5-methylthiophen-2-yl)ethanamine
PubChem CID116771802
Molecular FormulaC16H27NOS
Molecular Weight281.46 g/mol
Exact Mass281.18
IUPAC Name2-cyclohexyl-N-ethyl-2-methoxy-1-(5-methylthiophen-2-yl)ethanamine
SMILESCCNC(c1ccc(C)s1)C(OC)C1CCCCC1
InChIInChI=1S/C16H27NOS/c1-4-17-15(14-11-10-12(2)19-14)16(18-3)13-8-6-5-7-9-13/h10-11,13,15-17H,4-9H2,1-3H3
InChIKeyNLVHYSQRAJRPSU-UHFFFAOYSA-N
XLogP4.30
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.46
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-cyclohexyl-N-ethyl-2-methoxy-1-(5-methylthiophen-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

2-cyclohexyl-1-(3,4-dimethylphenyl)-N-ethyl-2-methoxyethanamine
CID 116771781
1,2-dicyclohexyl-N-ethyl-2-methoxyethanamine
CID 116771642
N-ethyl-2-methoxy-1-(5-methylthiophen-2-yl)-2-phenylethanamine
CID 116773182
3-(5-bromothiophen-2-yl)-1-cyclohexyl-N-ethyl-1-methoxypropan-2-amine
CID 116771653
2-cyclopropyl-2-methoxy-1-(5-methylthiophen-2-yl)ethanol
CID 116712529
1-cyclohexyl-N-ethyl-1-methoxy-3-methylbutan-2-amine
CID 116771723
2-cyclohexyl-N-ethyl-1-(3-fluoro-4-pyridinyl)-2-methoxyethanamine
CID 116771778
1-(3-bromo-2-fluorophenyl)-2-cyclohexyl-N-ethyl-2-methoxyethanamine
CID 106646184
2-cyclopropyl-1-(5-methylthiophen-2-yl)-N-propylpropan-1-amine
CID 83154582
1-cyclohexyl-N-[1-(5-methylthiophen-2-yl)ethyl]propan-1-amine
CID 63477674
2-cyclopropyl-N-ethyl-2-methoxy-1-thiophen-3-ylethanamine
CID 116722511
(1R)-1-cyclohexyl-N-[1-(5-methylthiophen-2-yl)ethyl]ethanamine
CID 81384118

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-ethyl-2-methoxy-1-(5-methylthiophen-2-yl)ethanamine?
The IUPAC name of 2-cyclohexyl-N-ethyl-2-methoxy-1-(5-methylthiophen-2-yl)ethanamine (CID 116771802) is 2-cyclohexyl-N-ethyl-2-methoxy-1-(5-methylthiophen-2-yl)ethanamine.
What is the SMILES notation for 2-cyclohexyl-N-ethyl-2-methoxy-1-(5-methylthiophen-2-yl)ethanamine?
The canonical SMILES for 2-cyclohexyl-N-ethyl-2-methoxy-1-(5-methylthiophen-2-yl)ethanamine is CCNC(c1ccc(C)s1)C(OC)C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-N-ethyl-2-methoxy-1-(5-methylthiophen-2-yl)ethanamine?
The InChIKey is NLVHYSQRAJRPSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NOS/c1-4-17-15(14-11-10-12(2)19-14)16(18-3)13-8-6-5-7-9-13/h10-11,13,15-17H,4-9H2,1-3H3.
What are the key properties of 2-cyclohexyl-N-ethyl-2-methoxy-1-(5-methylthiophen-2-yl)ethanamine?
2-cyclohexyl-N-ethyl-2-methoxy-1-(5-methylthiophen-2-yl)ethanamine has a molecular weight of 281.46 g/mol, XLogP of 4.30, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-ethyl-2-methoxy-1-(5-methylthiophen-2-yl)ethanamine is sourced from PubChem (CID 116771802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).