1-(2-methoxyphenyl)-N-[2-(1,3-thiazol-4-yl)ethyl]propan-2-amine

C15H20N2OS — CID 63830235

IUPAC1-(2-methoxyphenyl)-N-[2-(1,3-thiazol-4-yl)ethyl]propan-2-amine
SMILESCOc1ccccc1CC(C)NCCc1cscn1
InChIInChI=1S/C15H20N2OS/c1-12(16-8-7-14-10-19-11-17-14)9-13-5-3-4-6-15(13)18-2/h3-6,10-12,16H,7-9H2,1-2H3
InChIKeyFIMUAQPFGQZLDY-UHFFFAOYSA-N
MW276.41 g/mol
LogP2.91
Rot. Bonds7

About 1-(2-methoxyphenyl)-N-[2-(1,3-thiazol-4-yl)ethyl]propan-2-amine

1-(2-methoxyphenyl)-N-[2-(1,3-thiazol-4-yl)ethyl]propan-2-amine (PubChem CID 63830235) has the molecular formula C15H20N2OS and a molecular weight of 276.41 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-N-[2-(1,3-thiazol-4-yl)ethyl]propan-2-amine.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-N-[2-(1,3-thiazol-4-yl)ethyl]propan-2-amine
PubChem CID63830235
Molecular FormulaC15H20N2OS
Molecular Weight276.41 g/mol
Exact Mass276.13
IUPAC Name1-(2-methoxyphenyl)-N-[2-(1,3-thiazol-4-yl)ethyl]propan-2-amine
SMILESCOc1ccccc1CC(C)NCCc1cscn1
InChIInChI=1S/C15H20N2OS/c1-12(16-8-7-14-10-19-11-17-14)9-13-5-3-4-6-15(13)18-2/h3-6,10-12,16H,7-9H2,1-2H3
InChIKeyFIMUAQPFGQZLDY-UHFFFAOYSA-N
XLogP2.91
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.41
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-fluoro-6-methoxyphenyl)-N-[2-(1,3-thiazol-4-yl)ethyl]ethanamine
CID 112700803
2-[1-(2-methoxyphenyl)propan-2-ylamino]ethanol
CID 18627851
N-(2-fluoroethyl)-1-(2-methoxyphenyl)propan-2-amine
CID 110174086
N-[2-(1,3-thiazol-4-yl)ethyl]-1-thiophen-3-ylpropan-2-amine
CID 115731927
N-[2-(2-methoxyphenyl)ethyl]-1-(2-methylphenyl)propan-2-amine
CID 57276686
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-methoxyphenyl)propan-2-amine
CID 119164539
N-[2-(4-chlorophenyl)ethyl]-1-(2-methoxyphenyl)propan-2-amine
CID 43767012
N-[1-(2-methoxyphenyl)propan-2-yl]pentan-1-amine
CID 43757590
1-(2,4-dimethoxyphenyl)-N-[2-(1,3-thiazol-4-yl)ethyl]ethanamine
CID 63831507
(1S)-1-(2-methoxyphenyl)-N-(1,3-thiazol-4-ylmethyl)ethanamine
CID 81396914
2-(2-methoxyphenyl)-N-(1,3-thiazol-4-ylmethyl)acetamide
CID 49346575
1-(2-methoxyphenyl)-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propan-2-amine
CID 55170907

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-N-[2-(1,3-thiazol-4-yl)ethyl]propan-2-amine?
The IUPAC name of 1-(2-methoxyphenyl)-N-[2-(1,3-thiazol-4-yl)ethyl]propan-2-amine (CID 63830235) is 1-(2-methoxyphenyl)-N-[2-(1,3-thiazol-4-yl)ethyl]propan-2-amine.
What is the SMILES notation for 1-(2-methoxyphenyl)-N-[2-(1,3-thiazol-4-yl)ethyl]propan-2-amine?
The canonical SMILES for 1-(2-methoxyphenyl)-N-[2-(1,3-thiazol-4-yl)ethyl]propan-2-amine is COc1ccccc1CC(C)NCCc1cscn1.
What is the InChIKey of 1-(2-methoxyphenyl)-N-[2-(1,3-thiazol-4-yl)ethyl]propan-2-amine?
The InChIKey is FIMUAQPFGQZLDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2OS/c1-12(16-8-7-14-10-19-11-17-14)9-13-5-3-4-6-15(13)18-2/h3-6,10-12,16H,7-9H2,1-2H3.
What are the key properties of 1-(2-methoxyphenyl)-N-[2-(1,3-thiazol-4-yl)ethyl]propan-2-amine?
1-(2-methoxyphenyl)-N-[2-(1,3-thiazol-4-yl)ethyl]propan-2-amine has a molecular weight of 276.41 g/mol, XLogP of 2.91, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-N-[2-(1,3-thiazol-4-yl)ethyl]propan-2-amine is sourced from PubChem (CID 63830235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).