1-(2-methoxyphenyl)-N-propyl-3-thiophen-2-ylpropan-2-amine

C17H23NOS — CID 62501184

IUPAC1-(2-methoxyphenyl)-N-propyl-3-thiophen-2-ylpropan-2-amine
SMILESCCCNC(Cc1cccs1)Cc1ccccc1OC
InChIInChI=1S/C17H23NOS/c1-3-10-18-15(13-16-8-6-11-20-16)12-14-7-4-5-9-17(14)19-2/h4-9,11,15,18H,3,10,12-13H2,1-2H3
InChIKeyBEXAVEUFOMNKMW-UHFFFAOYSA-N
MW289.44 g/mol
LogP3.91
Rot. Bonds8

About 1-(2-methoxyphenyl)-N-propyl-3-thiophen-2-ylpropan-2-amine

1-(2-methoxyphenyl)-N-propyl-3-thiophen-2-ylpropan-2-amine (PubChem CID 62501184) has the molecular formula C17H23NOS and a molecular weight of 289.44 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-N-propyl-3-thiophen-2-ylpropan-2-amine.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-N-propyl-3-thiophen-2-ylpropan-2-amine
PubChem CID62501184
Molecular FormulaC17H23NOS
Molecular Weight289.44 g/mol
Exact Mass289.15
IUPAC Name1-(2-methoxyphenyl)-N-propyl-3-thiophen-2-ylpropan-2-amine
SMILESCCCNC(Cc1cccs1)Cc1ccccc1OC
InChIInChI=1S/C17H23NOS/c1-3-10-18-15(13-16-8-6-11-20-16)12-14-7-4-5-9-17(14)19-2/h4-9,11,15,18H,3,10,12-13H2,1-2H3
InChIKeyBEXAVEUFOMNKMW-UHFFFAOYSA-N
XLogP3.91
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.44
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-bromo-2-methoxyphenyl)-N-propyl-3-thiophen-2-ylpropan-2-amine
CID 62501357
1-(2-methoxyphenyl)-3-phenyl-N-propylpropan-2-amine
CID 61263835
1-(5-fluoro-2-methylphenyl)-N-propyl-3-thiophen-2-ylpropan-2-amine
CID 105373823
1-(2-methoxyphenyl)-3-methylsulfanyl-N-propylpropan-2-amine
CID 55108619
1-(4-methoxyphenyl)-N-propyl-3-thiophen-2-ylpropan-2-amine
CID 62602722
4-ethyl-1-(2-methoxyphenyl)-N-propylhexan-2-amine
CID 82922595
N-ethyl-1-(2-methoxy-5-methylphenyl)-3-thiophen-2-ylpropan-2-amine
CID 62501355
4-(4-methoxyphenyl)-N-propyl-1-thiophen-2-ylbutan-2-amine
CID 61064106
1-(2-methoxyphenyl)-3-propan-2-ylsulfanyl-N-propylpropan-2-amine
CID 65131449
1-(5-chloro-2-methoxyphenyl)-N-ethyl-3-thiophen-2-ylpropan-2-amine
CID 62604361
1-(2-methoxyphenyl)-4-methyl-N-propylpent-4-en-2-amine
CID 79179978
1-(2-methoxyphenyl)-4,5,5-trimethyl-N-propylhexan-2-amine
CID 63833464

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-N-propyl-3-thiophen-2-ylpropan-2-amine?
The IUPAC name of 1-(2-methoxyphenyl)-N-propyl-3-thiophen-2-ylpropan-2-amine (CID 62501184) is 1-(2-methoxyphenyl)-N-propyl-3-thiophen-2-ylpropan-2-amine.
What is the SMILES notation for 1-(2-methoxyphenyl)-N-propyl-3-thiophen-2-ylpropan-2-amine?
The canonical SMILES for 1-(2-methoxyphenyl)-N-propyl-3-thiophen-2-ylpropan-2-amine is CCCNC(Cc1cccs1)Cc1ccccc1OC.
What is the InChIKey of 1-(2-methoxyphenyl)-N-propyl-3-thiophen-2-ylpropan-2-amine?
The InChIKey is BEXAVEUFOMNKMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NOS/c1-3-10-18-15(13-16-8-6-11-20-16)12-14-7-4-5-9-17(14)19-2/h4-9,11,15,18H,3,10,12-13H2,1-2H3.
What are the key properties of 1-(2-methoxyphenyl)-N-propyl-3-thiophen-2-ylpropan-2-amine?
1-(2-methoxyphenyl)-N-propyl-3-thiophen-2-ylpropan-2-amine has a molecular weight of 289.44 g/mol, XLogP of 3.91, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-N-propyl-3-thiophen-2-ylpropan-2-amine is sourced from PubChem (CID 62501184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).