2-amino-1-thiophen-2-yl-1-thiophen-3-ylethanol

C10H11NOS2 — CID 139027677

IUPAC2-amino-1-thiophen-2-yl-1-thiophen-3-ylethanol
SMILESNCC(O)(c1ccsc1)c1cccs1
InChIInChI=1S/C10H11NOS2/c11-7-10(12,8-3-5-13-6-8)9-2-1-4-14-9/h1-6,12H,7,11H2
InChIKeyPMGPBEKSXUWQFD-UHFFFAOYSA-N
MW225.34 g/mol
LogP2.00
Rot. Bonds3

About 2-amino-1-thiophen-2-yl-1-thiophen-3-ylethanol

2-amino-1-thiophen-2-yl-1-thiophen-3-ylethanol (PubChem CID 139027677) has the molecular formula C10H11NOS2 and a molecular weight of 225.34 g/mol. Its IUPAC name is 2-amino-1-thiophen-2-yl-1-thiophen-3-ylethanol.

Molecular Properties

Compound Name2-amino-1-thiophen-2-yl-1-thiophen-3-ylethanol
PubChem CID139027677
Molecular FormulaC10H11NOS2
Molecular Weight225.34 g/mol
Exact Mass225.03
IUPAC Name2-amino-1-thiophen-2-yl-1-thiophen-3-ylethanol
SMILESNCC(O)(c1ccsc1)c1cccs1
InChIInChI=1S/C10H11NOS2/c11-7-10(12,8-3-5-13-6-8)9-2-1-4-14-9/h1-6,12H,7,11H2
InChIKeyPMGPBEKSXUWQFD-UHFFFAOYSA-N
XLogP2.00
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 ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-N'-(2-hydroxy-2-thiophen-2-yl-2-thiophen-3-ylethyl)oxamide
CID 121170273
N-(2-hydroxy-2-thiophen-2-yl-2-thiophen-3-ylethyl)-2-thiophen-3-ylacetamide
CID 121170151
N-[(2R)-2-hydroxy-2-thiophen-2-yl-2-thiophen-3-ylethyl]-2,3,4,5,6-pentamethylbenzenesulfonamide
CID 124760232
N-[(2S)-2-hydroxy-2-thiophen-2-yl-2-thiophen-3-ylethyl]-2,3,4,5,6-pentamethylbenzenesulfonamide
CID 124760233
1-(2-hydroxy-2-thiophen-2-yl-2-thiophen-3-ylethyl)-3-propylurea
CID 121170348
N-benzyl-N'-(2-hydroxy-2-thiophen-2-yl-2-thiophen-3-ylethyl)oxamide
CID 121170286
N-(2-hydroxy-2-thiophen-2-yl-2-thiophen-3-ylethyl)-4-(trifluoromethyl)benzenesulfonamide
CID 121170241
(E)-N-[(2R)-2-hydroxy-2-thiophen-2-yl-2-thiophen-3-ylethyl]-2-phenylethenesulfonamide
CID 124878567
(E)-3-(furan-3-yl)-N-[(2S)-2-hydroxy-2-thiophen-2-yl-2-thiophen-3-ylethyl]prop-2-enamide
CID 124875177
N-[(2S)-2-hydroxy-2-thiophen-2-yl-2-thiophen-3-ylethyl]-2-oxoimidazolidine-1-carboxamide
CID 124759456
(E)-3-(furan-3-yl)-N-[(2R)-2-hydroxy-2-thiophen-2-yl-2-thiophen-3-ylethyl]prop-2-enamide
CID 124875174
(2S)-3-amino-1,1,1-trifluoro-2-thiophen-2-ylpropan-2-ol
CID 95011095

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-thiophen-2-yl-1-thiophen-3-ylethanol?
The IUPAC name of 2-amino-1-thiophen-2-yl-1-thiophen-3-ylethanol (CID 139027677) is 2-amino-1-thiophen-2-yl-1-thiophen-3-ylethanol.
What is the SMILES notation for 2-amino-1-thiophen-2-yl-1-thiophen-3-ylethanol?
The canonical SMILES for 2-amino-1-thiophen-2-yl-1-thiophen-3-ylethanol is NCC(O)(c1ccsc1)c1cccs1.
What is the InChIKey of 2-amino-1-thiophen-2-yl-1-thiophen-3-ylethanol?
The InChIKey is PMGPBEKSXUWQFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NOS2/c11-7-10(12,8-3-5-13-6-8)9-2-1-4-14-9/h1-6,12H,7,11H2.
What are the key properties of 2-amino-1-thiophen-2-yl-1-thiophen-3-ylethanol?
2-amino-1-thiophen-2-yl-1-thiophen-3-ylethanol has a molecular weight of 225.34 g/mol, XLogP of 2.00, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-thiophen-2-yl-1-thiophen-3-ylethanol is sourced from PubChem (CID 139027677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).