2-(5-ethylthiophen-2-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine

C18H31NS — CID 65425118

IUPAC2-(5-ethylthiophen-2-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine
SMILESCCCC1CCC(C(Cc2ccc(CC)s2)NC)CC1
InChIInChI=1S/C18H31NS/c1-4-6-14-7-9-15(10-8-14)18(19-3)13-17-12-11-16(5-2)20-17/h11-12,14-15,18-19H,4-10,13H2,1-3H3
InChIKeyKQDQVDNIZAFOSL-UHFFFAOYSA-N
MW293.52 g/mol
LogP5.05
Rot. Bonds7

About 2-(5-ethylthiophen-2-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine

2-(5-ethylthiophen-2-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine (PubChem CID 65425118) has the molecular formula C18H31NS and a molecular weight of 293.52 g/mol. Its IUPAC name is 2-(5-ethylthiophen-2-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine.

Molecular Properties

Compound Name2-(5-ethylthiophen-2-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine
PubChem CID65425118
Molecular FormulaC18H31NS
Molecular Weight293.52 g/mol
Exact Mass293.22
IUPAC Name2-(5-ethylthiophen-2-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine
SMILESCCCC1CCC(C(Cc2ccc(CC)s2)NC)CC1
InChIInChI=1S/C18H31NS/c1-4-6-14-7-9-15(10-8-14)18(19-3)13-17-12-11-16(5-2)20-17/h11-12,14-15,18-19H,4-10,13H2,1-3H3
InChIKeyKQDQVDNIZAFOSL-UHFFFAOYSA-N
XLogP5.05
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500293.52
LogP ≤ 55.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(5-ethylthiophen-2-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine with MolForge

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Related Compounds

1-(4,4-dimethylcyclohexyl)-2-(5-ethylthiophen-2-yl)-N-methylethanamine
CID 65391425
N-[1-(4-ethylcyclohexyl)-2-(5-ethylthiophen-2-yl)ethyl]propan-1-amine
CID 65392917
N-[1-cyclopropyl-2-(5-ethylthiophen-2-yl)ethyl]propan-1-amine
CID 62600030
2-(5-chlorothiophen-2-yl)-1-(4-ethylcyclohexyl)-N-methylethanamine
CID 65393739
2-(4-bromophenyl)-N-methyl-1-(4-propylcyclohexyl)ethanamine
CID 65425315
2-(furan-3-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine
CID 83175553
N-methyl-1-(4-propylcyclohexyl)butan-1-amine
CID 65423384
N-[1-cyclohexyl-2-(5-ethylthiophen-2-yl)ethyl]propan-1-amine
CID 63413397
N-ethyl-2-(5-ethylthiophen-2-yl)-1-(4-propan-2-ylcyclohexyl)ethanamine
CID 65423043
2-(5-bromothiophen-2-yl)-N-methyl-1-(4-propan-2-ylcyclohexyl)ethanamine
CID 65423025
2-(5-ethylthiophen-2-yl)-N-methyl-1-(2-methylcyclopropyl)ethanamine
CID 65422780
2-cyclopropyl-N-methyl-1-(4-propylcyclohexyl)ethanamine
CID 65423192

Frequently Asked Questions

What is the IUPAC name of 2-(5-ethylthiophen-2-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine?
The IUPAC name of 2-(5-ethylthiophen-2-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine (CID 65425118) is 2-(5-ethylthiophen-2-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine.
What is the SMILES notation for 2-(5-ethylthiophen-2-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine?
The canonical SMILES for 2-(5-ethylthiophen-2-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine is CCCC1CCC(C(Cc2ccc(CC)s2)NC)CC1.
What is the InChIKey of 2-(5-ethylthiophen-2-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine?
The InChIKey is KQDQVDNIZAFOSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H31NS/c1-4-6-14-7-9-15(10-8-14)18(19-3)13-17-12-11-16(5-2)20-17/h11-12,14-15,18-19H,4-10,13H2,1-3H3.
What are the key properties of 2-(5-ethylthiophen-2-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine?
2-(5-ethylthiophen-2-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine has a molecular weight of 293.52 g/mol, XLogP of 5.05, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethylthiophen-2-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine is sourced from PubChem (CID 65425118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).