(S)-[5-(aminomethyl)thiophen-2-yl]-(furan-3-yl)methanol

C10H11NO2S — CID 97102871

IUPAC(S)-[5-(aminomethyl)thiophen-2-yl]-(furan-3-yl)methanol
SMILESNCc1ccc([C@@H](O)c2ccoc2)s1
InChIInChI=1S/C10H11NO2S/c11-5-8-1-2-9(14-8)10(12)7-3-4-13-6-7/h1-4,6,10,12H,5,11H2/t10-/m0/s1
InChIKeyYMIVFQHLDCZDPY-JTQLQIEISA-N
MW209.27 g/mol
LogP1.88
Rot. Bonds3

About (S)-[5-(aminomethyl)thiophen-2-yl]-(furan-3-yl)methanol

(S)-[5-(aminomethyl)thiophen-2-yl]-(furan-3-yl)methanol (PubChem CID 97102871) has the molecular formula C10H11NO2S and a molecular weight of 209.27 g/mol. Its IUPAC name is (S)-[5-(aminomethyl)thiophen-2-yl]-(furan-3-yl)methanol.

Molecular Properties

Compound Name(S)-[5-(aminomethyl)thiophen-2-yl]-(furan-3-yl)methanol
PubChem CID97102871
Molecular FormulaC10H11NO2S
Molecular Weight209.27 g/mol
Exact Mass209.05
IUPAC Name(S)-[5-(aminomethyl)thiophen-2-yl]-(furan-3-yl)methanol
SMILESNCc1ccc([C@@H](O)c2ccoc2)s1
InChIInChI=1S/C10H11NO2S/c11-5-8-1-2-9(14-8)10(12)7-3-4-13-6-7/h1-4,6,10,12H,5,11H2/t10-/m0/s1
InChIKeyYMIVFQHLDCZDPY-JTQLQIEISA-N
XLogP1.88
TPSA59.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.27
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (S)-[5-(aminomethyl)thiophen-2-yl]-(furan-3-yl)methanol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (S)-[5-(aminomethyl)thiophen-2-yl]-(furan-3-yl)methanol?
The IUPAC name of (S)-[5-(aminomethyl)thiophen-2-yl]-(furan-3-yl)methanol (CID 97102871) is (S)-[5-(aminomethyl)thiophen-2-yl]-(furan-3-yl)methanol.
What is the SMILES notation for (S)-[5-(aminomethyl)thiophen-2-yl]-(furan-3-yl)methanol?
The canonical SMILES for (S)-[5-(aminomethyl)thiophen-2-yl]-(furan-3-yl)methanol is NCc1ccc([C@@H](O)c2ccoc2)s1.
What is the InChIKey of (S)-[5-(aminomethyl)thiophen-2-yl]-(furan-3-yl)methanol?
The InChIKey is YMIVFQHLDCZDPY-JTQLQIEISA-N. The full InChI is InChI=1S/C10H11NO2S/c11-5-8-1-2-9(14-8)10(12)7-3-4-13-6-7/h1-4,6,10,12H,5,11H2/t10-/m0/s1.
What are the key properties of (S)-[5-(aminomethyl)thiophen-2-yl]-(furan-3-yl)methanol?
(S)-[5-(aminomethyl)thiophen-2-yl]-(furan-3-yl)methanol has a molecular weight of 209.27 g/mol, XLogP of 1.88, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (S)-[5-(aminomethyl)thiophen-2-yl]-(furan-3-yl)methanol is sourced from PubChem (CID 97102871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).