(1R)-N-ethyl-2-(4-methylphenyl)-1-thiophen-2-ylethanamine

C15H19NS — CID 92968196

IUPAC(1R)-N-ethyl-2-(4-methylphenyl)-1-thiophen-2-ylethanamine
SMILESCCN[C@H](Cc1ccc(C)cc1)c1cccs1
InChIInChI=1S/C15H19NS/c1-3-16-14(15-5-4-10-17-15)11-13-8-6-12(2)7-9-13/h4-10,14,16H,3,11H2,1-2H3/t14-/m1/s1
InChIKeyPAODAZOYSMETGK-CQSZACIVSA-N
MW245.39 g/mol
LogP3.95
Rot. Bonds5

About (1R)-N-ethyl-2-(4-methylphenyl)-1-thiophen-2-ylethanamine

(1R)-N-ethyl-2-(4-methylphenyl)-1-thiophen-2-ylethanamine (PubChem CID 92968196) has the molecular formula C15H19NS and a molecular weight of 245.39 g/mol. Its IUPAC name is (1R)-N-ethyl-2-(4-methylphenyl)-1-thiophen-2-ylethanamine.

Molecular Properties

Compound Name(1R)-N-ethyl-2-(4-methylphenyl)-1-thiophen-2-ylethanamine
PubChem CID92968196
Molecular FormulaC15H19NS
Molecular Weight245.39 g/mol
Exact Mass245.12
IUPAC Name(1R)-N-ethyl-2-(4-methylphenyl)-1-thiophen-2-ylethanamine
SMILESCCN[C@H](Cc1ccc(C)cc1)c1cccs1
InChIInChI=1S/C15H19NS/c1-3-16-14(15-5-4-10-17-15)11-13-8-6-12(2)7-9-13/h4-10,14,16H,3,11H2,1-2H3/t14-/m1/s1
InChIKeyPAODAZOYSMETGK-CQSZACIVSA-N
XLogP3.95
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.39
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,5-dimethylphenyl)-N-ethyl-1-thiophen-2-ylethanamine
CID 54911205
N-ethyl-2-phenyl-1-thiophen-2-ylethanamine;hydrochloride
CID 3061989
N-ethyl-2-(4-propan-2-ylphenyl)-1-thiophen-2-ylethanamine
CID 55095629
[2-(4-methylphenyl)-1-thiophen-2-ylethyl]hydrazine
CID 105193700
N-[2-(4-methylphenyl)-1-thiophen-2-ylethyl]propan-2-amine
CID 3062035
2-(2,5-dimethylphenyl)-N-ethyl-1-thiophen-2-ylethanamine
CID 61481816
N-ethyl-1,2-dithiophen-2-ylethanamine
CID 43755169
N-ethyl-2-(2-methylphenyl)-1-thiophen-2-ylethanamine
CID 43490566
2-(3-bromophenyl)-N-ethyl-1-thiophen-2-ylethanamine
CID 60818969
[2-(4-ethylphenyl)-1-thiophen-2-ylethyl]hydrazine
CID 105193509
N-ethyl-4-methyl-1-thiophen-2-ylpentan-1-amine
CID 43490552
N-ethyl-1-thiophen-2-ylundecan-1-amine
CID 55186605

Frequently Asked Questions

What is the IUPAC name of (1R)-N-ethyl-2-(4-methylphenyl)-1-thiophen-2-ylethanamine?
The IUPAC name of (1R)-N-ethyl-2-(4-methylphenyl)-1-thiophen-2-ylethanamine (CID 92968196) is (1R)-N-ethyl-2-(4-methylphenyl)-1-thiophen-2-ylethanamine.
What is the SMILES notation for (1R)-N-ethyl-2-(4-methylphenyl)-1-thiophen-2-ylethanamine?
The canonical SMILES for (1R)-N-ethyl-2-(4-methylphenyl)-1-thiophen-2-ylethanamine is CCN[C@H](Cc1ccc(C)cc1)c1cccs1.
What is the InChIKey of (1R)-N-ethyl-2-(4-methylphenyl)-1-thiophen-2-ylethanamine?
The InChIKey is PAODAZOYSMETGK-CQSZACIVSA-N. The full InChI is InChI=1S/C15H19NS/c1-3-16-14(15-5-4-10-17-15)11-13-8-6-12(2)7-9-13/h4-10,14,16H,3,11H2,1-2H3/t14-/m1/s1.
What are the key properties of (1R)-N-ethyl-2-(4-methylphenyl)-1-thiophen-2-ylethanamine?
(1R)-N-ethyl-2-(4-methylphenyl)-1-thiophen-2-ylethanamine has a molecular weight of 245.39 g/mol, XLogP of 3.95, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-ethyl-2-(4-methylphenyl)-1-thiophen-2-ylethanamine is sourced from PubChem (CID 92968196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).