N-ethyl-2-(5-ethylthiophen-2-yl)-1-(4-propan-2-ylcyclohexyl)ethanamine

C19H33NS — CID 65423043

IUPACN-ethyl-2-(5-ethylthiophen-2-yl)-1-(4-propan-2-ylcyclohexyl)ethanamine
SMILESCCNC(Cc1ccc(CC)s1)C1CCC(C(C)C)CC1
InChIInChI=1S/C19H33NS/c1-5-17-11-12-18(21-17)13-19(20-6-2)16-9-7-15(8-10-16)14(3)4/h11-12,14-16,19-20H,5-10,13H2,1-4H3
InChIKeyMNMRDLFKEWXUGT-UHFFFAOYSA-N
MW307.55 g/mol
LogP5.29
Rot. Bonds7

About N-ethyl-2-(5-ethylthiophen-2-yl)-1-(4-propan-2-ylcyclohexyl)ethanamine

N-ethyl-2-(5-ethylthiophen-2-yl)-1-(4-propan-2-ylcyclohexyl)ethanamine (PubChem CID 65423043) has the molecular formula C19H33NS and a molecular weight of 307.55 g/mol. Its IUPAC name is N-ethyl-2-(5-ethylthiophen-2-yl)-1-(4-propan-2-ylcyclohexyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-(5-ethylthiophen-2-yl)-1-(4-propan-2-ylcyclohexyl)ethanamine
PubChem CID65423043
Molecular FormulaC19H33NS
Molecular Weight307.55 g/mol
Exact Mass307.23
IUPAC NameN-ethyl-2-(5-ethylthiophen-2-yl)-1-(4-propan-2-ylcyclohexyl)ethanamine
SMILESCCNC(Cc1ccc(CC)s1)C1CCC(C(C)C)CC1
InChIInChI=1S/C19H33NS/c1-5-17-11-12-18(21-17)13-19(20-6-2)16-9-7-15(8-10-16)14(3)4/h11-12,14-16,19-20H,5-10,13H2,1-4H3
InChIKeyMNMRDLFKEWXUGT-UHFFFAOYSA-N
XLogP5.29
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500307.55
LogP ≤ 55.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-cyclopropyl-2-(5-ethylthiophen-2-yl)ethyl]propan-1-amine
CID 62600030
N-ethyl-1-(3-ethylcyclohexyl)-2-(5-ethylthiophen-2-yl)ethanamine
CID 65415760
N-ethyl-2-(5-ethylthiophen-2-yl)-1-(5-methyloxolan-3-yl)ethanamine
CID 115842776
N-[1-(4-ethylcyclohexyl)-2-(5-ethylthiophen-2-yl)ethyl]propan-1-amine
CID 65392917
N-[1-cyclohexyl-2-(5-ethylthiophen-2-yl)ethyl]propan-1-amine
CID 63413397
2-(5-chlorothiophen-2-yl)-N-ethyl-1-(4-methylcyclohexyl)ethanamine
CID 55185869
2-(5-ethylthiophen-2-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine
CID 65425118
2-(5-chlorothiophen-2-yl)-1-(4,4-difluorocyclohexyl)-N-ethylethanamine
CID 105135106
[2-(5-ethylthiophen-2-yl)-1-(oxan-4-yl)ethyl]hydrazine
CID 105229678
1-(4,4-dimethylcyclohexyl)-2-(5-ethylthiophen-2-yl)-N-methylethanamine
CID 65391425
N-ethyl-1-(5-ethylthiophen-2-yl)-3-methylbutan-2-amine
CID 62600764
3-cyclopropyl-1-(5-ethylthiophen-2-yl)butan-2-amine
CID 115842635

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(5-ethylthiophen-2-yl)-1-(4-propan-2-ylcyclohexyl)ethanamine?
The IUPAC name of N-ethyl-2-(5-ethylthiophen-2-yl)-1-(4-propan-2-ylcyclohexyl)ethanamine (CID 65423043) is N-ethyl-2-(5-ethylthiophen-2-yl)-1-(4-propan-2-ylcyclohexyl)ethanamine.
What is the SMILES notation for N-ethyl-2-(5-ethylthiophen-2-yl)-1-(4-propan-2-ylcyclohexyl)ethanamine?
The canonical SMILES for N-ethyl-2-(5-ethylthiophen-2-yl)-1-(4-propan-2-ylcyclohexyl)ethanamine is CCNC(Cc1ccc(CC)s1)C1CCC(C(C)C)CC1.
What is the InChIKey of N-ethyl-2-(5-ethylthiophen-2-yl)-1-(4-propan-2-ylcyclohexyl)ethanamine?
The InChIKey is MNMRDLFKEWXUGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H33NS/c1-5-17-11-12-18(21-17)13-19(20-6-2)16-9-7-15(8-10-16)14(3)4/h11-12,14-16,19-20H,5-10,13H2,1-4H3.
What are the key properties of N-ethyl-2-(5-ethylthiophen-2-yl)-1-(4-propan-2-ylcyclohexyl)ethanamine?
N-ethyl-2-(5-ethylthiophen-2-yl)-1-(4-propan-2-ylcyclohexyl)ethanamine has a molecular weight of 307.55 g/mol, XLogP of 5.29, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(5-ethylthiophen-2-yl)-1-(4-propan-2-ylcyclohexyl)ethanamine is sourced from PubChem (CID 65423043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).