[5-(aminomethyl)thiophen-2-yl]-thiophen-2-ylmethanol

C10H11NOS2 — CID 71778092

IUPAC[5-(aminomethyl)thiophen-2-yl]-thiophen-2-ylmethanol
SMILESNCc1ccc(C(O)c2cccs2)s1
InChIInChI=1S/C10H11NOS2/c11-6-7-3-4-9(14-7)10(12)8-2-1-5-13-8/h1-5,10,12H,6,11H2
InChIKeyJMPVNIPMSRUIQG-UHFFFAOYSA-N
MW225.34 g/mol
LogP2.35
Rot. Bonds3

About [5-(aminomethyl)thiophen-2-yl]-thiophen-2-ylmethanol

[5-(aminomethyl)thiophen-2-yl]-thiophen-2-ylmethanol (PubChem CID 71778092) has the molecular formula C10H11NOS2 and a molecular weight of 225.34 g/mol. Its IUPAC name is [5-(aminomethyl)thiophen-2-yl]-thiophen-2-ylmethanol.

Molecular Properties

Compound Name[5-(aminomethyl)thiophen-2-yl]-thiophen-2-ylmethanol
PubChem CID71778092
Molecular FormulaC10H11NOS2
Molecular Weight225.34 g/mol
Exact Mass225.03
IUPAC Name[5-(aminomethyl)thiophen-2-yl]-thiophen-2-ylmethanol
SMILESNCc1ccc(C(O)c2cccs2)s1
InChIInChI=1S/C10H11NOS2/c11-6-7-3-4-9(14-7)10(12)8-2-1-5-13-8/h1-5,10,12H,6,11H2
InChIKeyJMPVNIPMSRUIQG-UHFFFAOYSA-N
XLogP2.35
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-Amino-1-(thiophen-2-yl)ethan-1-ol
CID 436152
Dithiophen-2-ylmethanol
CID 237664
3-Amino-1-(thiophen-2-yl)butan-1-ol
CID 66989084
[3-(Aminomethyl)-2-thienyl](phenyl)methanol
CID 56663483
Amino(thiophen-2-yl)methanol
CID 53928695
N-({5-[Hydroxy(thiophen-2-YL)methyl]thiophen-2-YL}methyl)cyclopropanesulfonamide
CID 71804667
(E)-N-((5-(hydroxy(thiophen-2-yl)methyl)thiophen-2-yl)methyl)-2-phenylethenesulfonamide
CID 71804669
2-fluoro-N-((5-(hydroxy(thiophen-2-yl)methyl)thiophen-2-yl)methyl)benzenesulfonamide
CID 71804668
N-[(2S)-2-hydroxy-2-(5-thiophen-2-ylthiophen-2-yl)ethyl]cyclopropanesulfonamide
CID 164636569
(1S)-3-amino-1-(thiophen-2-yl)propan-1-ol
CID 28267103
4-fluoro-N-((5-(hydroxy(thiophen-2-yl)methyl)thiophen-2-yl)methyl)benzenesulfonamide
CID 90583594
3-fluoro-N-((5-(hydroxy(thiophen-2-yl)methyl)thiophen-2-yl)methyl)benzenesulfonamide
CID 90583595

Frequently Asked Questions

What is the IUPAC name of [5-(aminomethyl)thiophen-2-yl]-thiophen-2-ylmethanol?
The IUPAC name of [5-(aminomethyl)thiophen-2-yl]-thiophen-2-ylmethanol (CID 71778092) is [5-(aminomethyl)thiophen-2-yl]-thiophen-2-ylmethanol.
What is the SMILES notation for [5-(aminomethyl)thiophen-2-yl]-thiophen-2-ylmethanol?
The canonical SMILES for [5-(aminomethyl)thiophen-2-yl]-thiophen-2-ylmethanol is NCc1ccc(C(O)c2cccs2)s1.
What is the InChIKey of [5-(aminomethyl)thiophen-2-yl]-thiophen-2-ylmethanol?
The InChIKey is JMPVNIPMSRUIQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NOS2/c11-6-7-3-4-9(14-7)10(12)8-2-1-5-13-8/h1-5,10,12H,6,11H2.
What are the key properties of [5-(aminomethyl)thiophen-2-yl]-thiophen-2-ylmethanol?
[5-(aminomethyl)thiophen-2-yl]-thiophen-2-ylmethanol has a molecular weight of 225.34 g/mol, XLogP of 2.35, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(aminomethyl)thiophen-2-yl]-thiophen-2-ylmethanol is sourced from PubChem (CID 71778092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).