[4-(2-amino-1-thiophen-2-ylpropoxy)phenyl]methanol

C14H17NO2S — CID 55021050

IUPAC[4-(2-amino-1-thiophen-2-ylpropoxy)phenyl]methanol
SMILESCC(N)C(Oc1ccc(CO)cc1)c1cccs1
InChIInChI=1S/C14H17NO2S/c1-10(15)14(13-3-2-8-18-13)17-12-6-4-11(9-16)5-7-12/h2-8,10,14,16H,9,15H2,1H3
InChIKeyJTHDNYJWIZFFHG-UHFFFAOYSA-N
MW263.36 g/mol
LogP2.71
Rot. Bonds5

About [4-(2-amino-1-thiophen-2-ylpropoxy)phenyl]methanol

[4-(2-amino-1-thiophen-2-ylpropoxy)phenyl]methanol (PubChem CID 55021050) has the molecular formula C14H17NO2S and a molecular weight of 263.36 g/mol. Its IUPAC name is [4-(2-amino-1-thiophen-2-ylpropoxy)phenyl]methanol.

Molecular Properties

Compound Name[4-(2-amino-1-thiophen-2-ylpropoxy)phenyl]methanol
PubChem CID55021050
Molecular FormulaC14H17NO2S
Molecular Weight263.36 g/mol
Exact Mass263.10
IUPAC Name[4-(2-amino-1-thiophen-2-ylpropoxy)phenyl]methanol
SMILESCC(N)C(Oc1ccc(CO)cc1)c1cccs1
InChIInChI=1S/C14H17NO2S/c1-10(15)14(13-3-2-8-18-13)17-12-6-4-11(9-16)5-7-12/h2-8,10,14,16H,9,15H2,1H3
InChIKeyJTHDNYJWIZFFHG-UHFFFAOYSA-N
XLogP2.71
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 ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [4-(2-amino-1-thiophen-2-ylpropoxy)phenyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[4-(2-methylbutan-2-yl)phenoxy]-1-thiophen-2-ylpropan-2-amine
CID 63458598
1-(3-methylphenoxy)-1-thiophen-2-ylpropan-2-amine
CID 55020853
3-(2-amino-1-thiophen-2-ylpropoxy)-5-methoxybenzonitrile
CID 103566523
3-methyl-1-thiophen-2-yl-1-[4-(trifluoromethyl)phenoxy]butan-2-amine
CID 175064848
2-[4-(2-amino-1-thiophen-3-ylpropoxy)phenyl]ethanol
CID 107708523
[4-(1-thiophen-2-ylethylsulfinylmethyl)phenyl]methanol
CID 110004990
1-(2,3-difluorophenoxy)-1-thiophen-2-ylpropan-2-amine
CID 63038311
2-[4-[(1S)-3-(methylamino)-1-thiophen-2-ylpropoxy]phenyl]ethanol
CID 90229934
1-(2-chloro-4-methylphenoxy)-1-thiophen-2-ylpropan-2-amine
CID 62670759
1-(4-chloro-2-methylphenoxy)-1-thiophen-2-ylpropan-2-amine
CID 55021040
2-[4-(hydroxymethyl)phenoxy]propanamide
CID 43082830
2-propan-2-ylthiophene
CID 178128598

Frequently Asked Questions

What is the IUPAC name of [4-(2-amino-1-thiophen-2-ylpropoxy)phenyl]methanol?
The IUPAC name of [4-(2-amino-1-thiophen-2-ylpropoxy)phenyl]methanol (CID 55021050) is [4-(2-amino-1-thiophen-2-ylpropoxy)phenyl]methanol.
What is the SMILES notation for [4-(2-amino-1-thiophen-2-ylpropoxy)phenyl]methanol?
The canonical SMILES for [4-(2-amino-1-thiophen-2-ylpropoxy)phenyl]methanol is CC(N)C(Oc1ccc(CO)cc1)c1cccs1.
What is the InChIKey of [4-(2-amino-1-thiophen-2-ylpropoxy)phenyl]methanol?
The InChIKey is JTHDNYJWIZFFHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2S/c1-10(15)14(13-3-2-8-18-13)17-12-6-4-11(9-16)5-7-12/h2-8,10,14,16H,9,15H2,1H3.
What are the key properties of [4-(2-amino-1-thiophen-2-ylpropoxy)phenyl]methanol?
[4-(2-amino-1-thiophen-2-ylpropoxy)phenyl]methanol has a molecular weight of 263.36 g/mol, XLogP of 2.71, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-amino-1-thiophen-2-ylpropoxy)phenyl]methanol is sourced from PubChem (CID 55021050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).