N,N-dimethyl-2-(1-pyridin-2-yl-1-thiophen-2-ylethoxy)ethanamine;hydrochloride

C15H21ClN2OS — CID 3056387

IUPACN,N-dimethyl-2-(1-pyridin-2-yl-1-thiophen-2-ylethoxy)ethanamine;hydrochloride
SMILESCN(C)CCOC(C)(c1ccccn1)c1cccs1.Cl
InChIInChI=1S/C15H20N2OS.ClH/c1-15(14-8-6-12-19-14,18-11-10-17(2)3)13-7-4-5-9-16-13;/h4-9,12H,10-11H2,1-3H3;1H
InChIKeyWKIQLIXJPINLKW-UHFFFAOYSA-N
MW312.87 g/mol
LogP3.41
Rot. Bonds6

About N,N-dimethyl-2-(1-pyridin-2-yl-1-thiophen-2-ylethoxy)ethanamine;hydrochloride

N,N-dimethyl-2-(1-pyridin-2-yl-1-thiophen-2-ylethoxy)ethanamine;hydrochloride (PubChem CID 3056387) has the molecular formula C15H21ClN2OS and a molecular weight of 312.87 g/mol. Its IUPAC name is N,N-dimethyl-2-(1-pyridin-2-yl-1-thiophen-2-ylethoxy)ethanamine;hydrochloride.

Molecular Properties

Compound NameN,N-dimethyl-2-(1-pyridin-2-yl-1-thiophen-2-ylethoxy)ethanamine;hydrochloride
PubChem CID3056387
Molecular FormulaC15H21ClN2OS
Molecular Weight312.87 g/mol
Exact Mass312.11
IUPAC NameN,N-dimethyl-2-(1-pyridin-2-yl-1-thiophen-2-ylethoxy)ethanamine;hydrochloride
SMILESCN(C)CCOC(C)(c1ccccn1)c1cccs1.Cl
InChIInChI=1S/C15H20N2OS.ClH/c1-15(14-8-6-12-19-14,18-11-10-17(2)3)13-7-4-5-9-16-13;/h4-9,12H,10-11H2,1-3H3;1H
InChIKeyWKIQLIXJPINLKW-UHFFFAOYSA-N
XLogP3.41
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.87
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

butanedioate;butanedioic acid;N,N-dimethyl-2-(1-phenyl-1-pyridin-2-ylethoxy)ethanamine
CID 23617069
N-methyl-N-[2-(1-phenyl-1-pyridin-2-ylethoxy)ethyl]nitrous amide
CID 171390106
4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol;N,N-dimethyl-2-(1-phenyl-1-pyridin-2-ylethoxy)ethanamine
CID 67437784
N-diphenoxyphosphoryl-N-methyl-2-(1-phenyl-1-pyridin-2-ylethoxy)ethanamine
CID 91056343
tris(butanedioic acid);bis(N,N-dimethyl-2-(1-phenyl-1-pyridin-4-ylethoxy)ethanamine)
CID 163339088
2-[1-(4-chlorophenyl)-1-phenylethoxy]-N,N-dimethylethanamine;hydrochloride
CID 11223
1-[2-(dimethylamino)ethylamino]-2-thiophen-2-ylpropan-2-ol
CID 112501508
3,6-bis(2-pyridin-2-ylpropan-2-yl)pyridazine
CID 143616932
2-(2-pyridin-2-ylpropan-2-yloxy)ethanol
CID 141291865
N,N-dimethyl-N'-pyridin-2-yl-N'-(thiophen-2-ylmethyl)ethane-1,2-diamine chloride
CID 45114124
2-chloro-5-[2-(dimethylamino)ethyl]-11H-benzo[b][1,4]benzodiazepin-6-one;N,N-dimethyl-2-(1-phenyl-1-pyridin-2-ylethoxy)ethanamine
CID 67319865
N,N-dimethyl-2-[(4-phenyl-1,3-thiazol-2-yl)oxy]ethanamine
CID 119090043

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(1-pyridin-2-yl-1-thiophen-2-ylethoxy)ethanamine;hydrochloride?
The IUPAC name of N,N-dimethyl-2-(1-pyridin-2-yl-1-thiophen-2-ylethoxy)ethanamine;hydrochloride (CID 3056387) is N,N-dimethyl-2-(1-pyridin-2-yl-1-thiophen-2-ylethoxy)ethanamine;hydrochloride.
What is the SMILES notation for N,N-dimethyl-2-(1-pyridin-2-yl-1-thiophen-2-ylethoxy)ethanamine;hydrochloride?
The canonical SMILES for N,N-dimethyl-2-(1-pyridin-2-yl-1-thiophen-2-ylethoxy)ethanamine;hydrochloride is CN(C)CCOC(C)(c1ccccn1)c1cccs1.Cl.
What is the InChIKey of N,N-dimethyl-2-(1-pyridin-2-yl-1-thiophen-2-ylethoxy)ethanamine;hydrochloride?
The InChIKey is WKIQLIXJPINLKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2OS.ClH/c1-15(14-8-6-12-19-14,18-11-10-17(2)3)13-7-4-5-9-16-13;/h4-9,12H,10-11H2,1-3H3;1H.
What are the key properties of N,N-dimethyl-2-(1-pyridin-2-yl-1-thiophen-2-ylethoxy)ethanamine;hydrochloride?
N,N-dimethyl-2-(1-pyridin-2-yl-1-thiophen-2-ylethoxy)ethanamine;hydrochloride has a molecular weight of 312.87 g/mol, XLogP of 3.41, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(1-pyridin-2-yl-1-thiophen-2-ylethoxy)ethanamine;hydrochloride is sourced from PubChem (CID 3056387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).