N-ethyl-2-phenyl-1-thiophen-2-ylethanamine;hydrochloride

C14H18ClNS — CID 3061989

IUPACN-ethyl-2-phenyl-1-thiophen-2-ylethanamine;hydrochloride
SMILESCCNC(Cc1ccccc1)c1cccs1.Cl
InChIInChI=1S/C14H17NS.ClH/c1-2-15-13(14-9-6-10-16-14)11-12-7-4-3-5-8-12;/h3-10,13,15H,2,11H2,1H3;1H
InChIKeyWJPCARRHQBEWSP-UHFFFAOYSA-N
MW267.82 g/mol
LogP4.06
Rot. Bonds5

About N-ethyl-2-phenyl-1-thiophen-2-ylethanamine;hydrochloride

N-ethyl-2-phenyl-1-thiophen-2-ylethanamine;hydrochloride (PubChem CID 3061989) has the molecular formula C14H18ClNS and a molecular weight of 267.82 g/mol. Its IUPAC name is N-ethyl-2-phenyl-1-thiophen-2-ylethanamine;hydrochloride.

Molecular Properties

Compound NameN-ethyl-2-phenyl-1-thiophen-2-ylethanamine;hydrochloride
PubChem CID3061989
Molecular FormulaC14H18ClNS
Molecular Weight267.82 g/mol
Exact Mass267.08
IUPAC NameN-ethyl-2-phenyl-1-thiophen-2-ylethanamine;hydrochloride
SMILESCCNC(Cc1ccccc1)c1cccs1.Cl
InChIInChI=1S/C14H17NS.ClH/c1-2-15-13(14-9-6-10-16-14)11-12-7-4-3-5-8-12;/h3-10,13,15H,2,11H2,1H3;1H
InChIKeyWJPCARRHQBEWSP-UHFFFAOYSA-N
XLogP4.06
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.82
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-N-ethyl-2-(4-methylphenyl)-1-thiophen-2-ylethanamine
CID 92968196
N-ethyl-2-(4-propan-2-ylphenyl)-1-thiophen-2-ylethanamine
CID 55095629
2-(3,5-dimethylphenyl)-N-ethyl-1-thiophen-2-ylethanamine
CID 54911205
2-(3-bromophenyl)-N-ethyl-1-thiophen-2-ylethanamine
CID 60818969
N-ethyl-1,2-dithiophen-2-ylethanamine
CID 43755169
N-ethyl-2-(2-methylphenyl)-1-thiophen-2-ylethanamine
CID 43490566
N-(2-phenyl-1-thiophen-2-ylethyl)ethanesulfonamide
CID 56791791
N-ethyl-4-methyl-1-thiophen-2-ylpentan-1-amine
CID 43490552
2-(2,5-dimethylphenyl)-N-ethyl-1-thiophen-2-ylethanamine
CID 61481816
[2-(4-ethylphenyl)-1-thiophen-2-ylethyl]hydrazine
CID 105193509
N-ethyl-1-thiophen-2-ylundecan-1-amine
CID 55186605
3-phenyl-N-propyl-1-thiophen-2-ylpropan-1-amine
CID 43495958

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-phenyl-1-thiophen-2-ylethanamine;hydrochloride?
The IUPAC name of N-ethyl-2-phenyl-1-thiophen-2-ylethanamine;hydrochloride (CID 3061989) is N-ethyl-2-phenyl-1-thiophen-2-ylethanamine;hydrochloride.
What is the SMILES notation for N-ethyl-2-phenyl-1-thiophen-2-ylethanamine;hydrochloride?
The canonical SMILES for N-ethyl-2-phenyl-1-thiophen-2-ylethanamine;hydrochloride is CCNC(Cc1ccccc1)c1cccs1.Cl.
What is the InChIKey of N-ethyl-2-phenyl-1-thiophen-2-ylethanamine;hydrochloride?
The InChIKey is WJPCARRHQBEWSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NS.ClH/c1-2-15-13(14-9-6-10-16-14)11-12-7-4-3-5-8-12;/h3-10,13,15H,2,11H2,1H3;1H.
What are the key properties of N-ethyl-2-phenyl-1-thiophen-2-ylethanamine;hydrochloride?
N-ethyl-2-phenyl-1-thiophen-2-ylethanamine;hydrochloride has a molecular weight of 267.82 g/mol, XLogP of 4.06, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-phenyl-1-thiophen-2-ylethanamine;hydrochloride is sourced from PubChem (CID 3061989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).