N-ethyl-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3-thiophen-3-ylpropan-2-amine

C17H24N2OS — CID 105136873

IUPACN-ethyl-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3-thiophen-3-ylpropan-2-amine
SMILESCCNC(Cc1ccsc1)Cc1ncc(C)c(OC)c1C
InChIInChI=1S/C17H24N2OS/c1-5-18-15(8-14-6-7-21-11-14)9-16-13(3)17(20-4)12(2)10-19-16/h6-7,10-11,15,18H,5,8-9H2,1-4H3
InChIKeyUGXJHNDRUSOWHW-UHFFFAOYSA-N
MW304.46 g/mol
LogP3.53
Rot. Bonds7

About N-ethyl-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3-thiophen-3-ylpropan-2-amine

N-ethyl-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3-thiophen-3-ylpropan-2-amine (PubChem CID 105136873) has the molecular formula C17H24N2OS and a molecular weight of 304.46 g/mol. Its IUPAC name is N-ethyl-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3-thiophen-3-ylpropan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3-thiophen-3-ylpropan-2-amine
PubChem CID105136873
Molecular FormulaC17H24N2OS
Molecular Weight304.46 g/mol
Exact Mass304.16
IUPAC NameN-ethyl-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3-thiophen-3-ylpropan-2-amine
SMILESCCNC(Cc1ccsc1)Cc1ncc(C)c(OC)c1C
InChIInChI=1S/C17H24N2OS/c1-5-18-15(8-14-6-7-21-11-14)9-16-13(3)17(20-4)12(2)10-19-16/h6-7,10-11,15,18H,5,8-9H2,1-4H3
InChIKeyUGXJHNDRUSOWHW-UHFFFAOYSA-N
XLogP3.53
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.46
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3-methylsulfanylpropan-2-amine
CID 62691956
N-ethyl-5-methoxy-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-4-methylpentan-2-amine
CID 105136877
[1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3-phenylpropan-2-yl]hydrazine
CID 105195369
N-ethyl-1-methoxy-3-thiophen-3-ylpropan-2-amine
CID 62604477
1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methyl-3-(thiophen-3-ylmethyl)guanidine;hydroiodide
CID 111939412
1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N-propylhexan-2-amine
CID 79412204
N-ethyl-1-(1-methylpyrazol-4-yl)-3-thiophen-3-ylpropan-2-amine
CID 105113824
1-cyclopentyl-N-ethyl-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanamine
CID 62601412
1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3-methylsulfonyl-N-propylpropan-2-amine
CID 115601880
1-cyclohexyl-N-ethyl-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanamine
CID 62601994
1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N-methyl-3-propan-2-ylsulfanylpropan-2-amine
CID 65131604
1-(3-chlorothiophen-2-yl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N-methylethanamine
CID 115843919

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3-thiophen-3-ylpropan-2-amine?
The IUPAC name of N-ethyl-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3-thiophen-3-ylpropan-2-amine (CID 105136873) is N-ethyl-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3-thiophen-3-ylpropan-2-amine.
What is the SMILES notation for N-ethyl-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3-thiophen-3-ylpropan-2-amine?
The canonical SMILES for N-ethyl-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3-thiophen-3-ylpropan-2-amine is CCNC(Cc1ccsc1)Cc1ncc(C)c(OC)c1C.
What is the InChIKey of N-ethyl-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3-thiophen-3-ylpropan-2-amine?
The InChIKey is UGXJHNDRUSOWHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2OS/c1-5-18-15(8-14-6-7-21-11-14)9-16-13(3)17(20-4)12(2)10-19-16/h6-7,10-11,15,18H,5,8-9H2,1-4H3.
What are the key properties of N-ethyl-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3-thiophen-3-ylpropan-2-amine?
N-ethyl-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3-thiophen-3-ylpropan-2-amine has a molecular weight of 304.46 g/mol, XLogP of 3.53, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3-thiophen-3-ylpropan-2-amine is sourced from PubChem (CID 105136873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).