(5-thiophen-2-yl-1,2-oxazol-3-yl)methanamine;hydrochloride

C8H9ClN2OS — CID 71779175

IUPAC(5-thiophen-2-yl-1,2-oxazol-3-yl)methanamine;hydrochloride
SMILESCl.NCc1cc(-c2cccs2)on1
InChIInChI=1S/C8H8N2OS.ClH/c9-5-6-4-7(11-10-6)8-2-1-3-12-8;/h1-4H,5,9H2;1H
InChIKeyZUJAWGBCQNRANH-UHFFFAOYSA-N
MW216.69 g/mol
LogP2.28
Rot. Bonds2

About (5-thiophen-2-yl-1,2-oxazol-3-yl)methanamine;hydrochloride

(5-thiophen-2-yl-1,2-oxazol-3-yl)methanamine;hydrochloride (PubChem CID 71779175) has the molecular formula C8H9ClN2OS and a molecular weight of 216.69 g/mol. Its IUPAC name is (5-thiophen-2-yl-1,2-oxazol-3-yl)methanamine;hydrochloride.

Molecular Properties

Compound Name(5-thiophen-2-yl-1,2-oxazol-3-yl)methanamine;hydrochloride
PubChem CID71779175
Molecular FormulaC8H9ClN2OS
Molecular Weight216.69 g/mol
Exact Mass216.01
IUPAC Name(5-thiophen-2-yl-1,2-oxazol-3-yl)methanamine;hydrochloride
SMILESCl.NCc1cc(-c2cccs2)on1
InChIInChI=1S/C8H8N2OS.ClH/c9-5-6-4-7(11-10-6)8-2-1-3-12-8;/h1-4H,5,9H2;1H
InChIKeyZUJAWGBCQNRANH-UHFFFAOYSA-N
XLogP2.28
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.69
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (5-thiophen-2-yl-1,2-oxazol-3-yl)methanamine;hydrochloride 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

N-cyclopropyl-5-(thiophen-2-yl)-1,2-oxazole-3-carboxamide
CID 19582717
N-Cyclohexyl-5-(thiophen-2-yl)isoxazole-3-carboxamide
CID 15998429
1-Piperidinyl-(5-thiophen-2-yl-3-isoxazolyl)methanone
CID 2745204
N-(propan-2-yl)-5-(thiophen-2-yl)-1,2-oxazole-3-carboxamide
CID 2745205
5-thien-2-yl-N-(thien-2-ylmethyl)isoxazole-3-carboxamide
CID 3238191
N-cyclopentyl-5-thien-2-ylisoxazole-3-carboxamide
CID 3242425
5-Thiophen-2-YL-isoxazole
CID 12049986
5-methyl-N-(thiophen-2-ylmethyl)-1,2-oxazole-3-carboxamide
CID 1245269
5-propyl-N-[(thiophen-2-yl)methyl]-1,2-oxazole-3-carboxamide
CID 5309850
N-Allyl-5-(thiophen-2-yl)isoxazole-3-carboxamide
CID 16000249
N-Cyclobutyl-5-(thiophen-2-yl)isoxazole-3-carboxamide
CID 24794414
N-Methyl-5-(thiophen-2-yl)isoxazole-3-carboxamide
CID 24794415

Frequently Asked Questions

What is the IUPAC name of (5-thiophen-2-yl-1,2-oxazol-3-yl)methanamine;hydrochloride?
The IUPAC name of (5-thiophen-2-yl-1,2-oxazol-3-yl)methanamine;hydrochloride (CID 71779175) is (5-thiophen-2-yl-1,2-oxazol-3-yl)methanamine;hydrochloride.
What is the SMILES notation for (5-thiophen-2-yl-1,2-oxazol-3-yl)methanamine;hydrochloride?
The canonical SMILES for (5-thiophen-2-yl-1,2-oxazol-3-yl)methanamine;hydrochloride is Cl.NCc1cc(-c2cccs2)on1.
What is the InChIKey of (5-thiophen-2-yl-1,2-oxazol-3-yl)methanamine;hydrochloride?
The InChIKey is ZUJAWGBCQNRANH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2OS.ClH/c9-5-6-4-7(11-10-6)8-2-1-3-12-8;/h1-4H,5,9H2;1H.
What are the key properties of (5-thiophen-2-yl-1,2-oxazol-3-yl)methanamine;hydrochloride?
(5-thiophen-2-yl-1,2-oxazol-3-yl)methanamine;hydrochloride has a molecular weight of 216.69 g/mol, XLogP of 2.28, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-thiophen-2-yl-1,2-oxazol-3-yl)methanamine;hydrochloride is sourced from PubChem (CID 71779175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).