3-amino-2-(2-methoxyphenyl)-1-thiophen-2-ylpropan-1-ol

C14H17NO2S — CID 65190276

IUPAC3-amino-2-(2-methoxyphenyl)-1-thiophen-2-ylpropan-1-ol
SMILESCOc1ccccc1C(CN)C(O)c1cccs1
InChIInChI=1S/C14H17NO2S/c1-17-12-6-3-2-5-10(12)11(9-15)14(16)13-7-4-8-18-13/h2-8,11,14,16H,9,15H2,1H3
InChIKeyBRSVZOSTAZLRPD-UHFFFAOYSA-N
MW263.36 g/mol
LogP2.53
Rot. Bonds5

About 3-amino-2-(2-methoxyphenyl)-1-thiophen-2-ylpropan-1-ol

3-amino-2-(2-methoxyphenyl)-1-thiophen-2-ylpropan-1-ol (PubChem CID 65190276) has the molecular formula C14H17NO2S and a molecular weight of 263.36 g/mol. Its IUPAC name is 3-amino-2-(2-methoxyphenyl)-1-thiophen-2-ylpropan-1-ol.

Molecular Properties

Compound Name3-amino-2-(2-methoxyphenyl)-1-thiophen-2-ylpropan-1-ol
PubChem CID65190276
Molecular FormulaC14H17NO2S
Molecular Weight263.36 g/mol
Exact Mass263.10
IUPAC Name3-amino-2-(2-methoxyphenyl)-1-thiophen-2-ylpropan-1-ol
SMILESCOc1ccccc1C(CN)C(O)c1cccs1
InChIInChI=1S/C14H17NO2S/c1-17-12-6-3-2-5-10(12)11(9-15)14(16)13-7-4-8-18-13/h2-8,11,14,16H,9,15H2,1H3
InChIKeyBRSVZOSTAZLRPD-UHFFFAOYSA-N
XLogP2.53
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.36
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-2-(5-chloro-2-methoxyphenyl)-1-thiophen-2-ylpropan-1-ol
CID 65190060
3-amino-1-(3,5-dimethylphenyl)-2-(2-methoxyphenyl)propan-1-ol
CID 65190689
(2-methoxyphenyl)-thiophen-2-ylmethanamine
CID 43186740
3-amino-2-(4-propan-2-ylphenyl)-1-thiophen-2-ylpropan-1-ol
CID 65189371
3-amino-2-(3,4-dimethylphenyl)-1-thiophen-2-ylpropan-1-ol
CID 65189679
2-amino-1-(2-methoxyphenyl)ethanol;hydrochloride
CID 54593518
3-amino-2-pyridin-4-yl-1-thiophen-2-ylpropan-1-ol
CID 80525921
3-amino-1-cyclopentyl-2-(2-methoxyphenyl)propan-1-ol
CID 65190124
3-amino-1-phenyl-2-thiophen-2-ylpropan-1-ol
CID 65190294
2-(2-methoxyphenyl)-1-thiophen-2-ylethanol
CID 61087312
3-amino-1-(3-bromo-4-chlorophenyl)-2-(2-methoxyphenyl)propan-1-ol
CID 107994881
N-(2-methoxyphenyl)-1-thiophen-2-ylethane-1,2-diamine
CID 65383986

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-(2-methoxyphenyl)-1-thiophen-2-ylpropan-1-ol?
The IUPAC name of 3-amino-2-(2-methoxyphenyl)-1-thiophen-2-ylpropan-1-ol (CID 65190276) is 3-amino-2-(2-methoxyphenyl)-1-thiophen-2-ylpropan-1-ol.
What is the SMILES notation for 3-amino-2-(2-methoxyphenyl)-1-thiophen-2-ylpropan-1-ol?
The canonical SMILES for 3-amino-2-(2-methoxyphenyl)-1-thiophen-2-ylpropan-1-ol is COc1ccccc1C(CN)C(O)c1cccs1.
What is the InChIKey of 3-amino-2-(2-methoxyphenyl)-1-thiophen-2-ylpropan-1-ol?
The InChIKey is BRSVZOSTAZLRPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2S/c1-17-12-6-3-2-5-10(12)11(9-15)14(16)13-7-4-8-18-13/h2-8,11,14,16H,9,15H2,1H3.
What are the key properties of 3-amino-2-(2-methoxyphenyl)-1-thiophen-2-ylpropan-1-ol?
3-amino-2-(2-methoxyphenyl)-1-thiophen-2-ylpropan-1-ol has a molecular weight of 263.36 g/mol, XLogP of 2.53, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-(2-methoxyphenyl)-1-thiophen-2-ylpropan-1-ol is sourced from PubChem (CID 65190276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).