3-thiophen-3-ylpropanamide;hydrochloride

C7H10ClNOS — CID 69413122

IUPAC3-thiophen-3-ylpropanamide;hydrochloride
SMILESCl.NC(=O)CCc1ccsc1
InChIInChI=1S/C7H9NOS.ClH/c8-7(9)2-1-6-3-4-10-5-6;/h3-5H,1-2H2,(H2,8,9);1H
InChIKeyQOMGTBBYUUGBNV-UHFFFAOYSA-N
MW191.68 g/mol
LogP1.59
Rot. Bonds3

About 3-thiophen-3-ylpropanamide;hydrochloride

3-thiophen-3-ylpropanamide;hydrochloride (PubChem CID 69413122) has the molecular formula C7H10ClNOS and a molecular weight of 191.68 g/mol. Its IUPAC name is 3-thiophen-3-ylpropanamide;hydrochloride.

Molecular Properties

Compound Name3-thiophen-3-ylpropanamide;hydrochloride
PubChem CID69413122
Molecular FormulaC7H10ClNOS
Molecular Weight191.68 g/mol
Exact Mass191.02
IUPAC Name3-thiophen-3-ylpropanamide;hydrochloride
SMILESCl.NC(=O)CCc1ccsc1
InChIInChI=1S/C7H9NOS.ClH/c8-7(9)2-1-6-3-4-10-5-6;/h3-5H,1-2H2,(H2,8,9);1H
InChIKeyQOMGTBBYUUGBNV-UHFFFAOYSA-N
XLogP1.59
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.68
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-Thiopheneacetamide, alpha-(1-methylethyl)-
CID 3056607
2-(Thiophen-3-yl)butanimidic acid
CID 3056614
2-(Thiophen-3-yl)acetamide
CID 566335
3-Thiopheneacetamide, alpha-(1-methylpropyl)-
CID 3056597
3-Ethyl-2-(thiophen-3-yl)pentanimidic acid
CID 3056598
3-Methyl-2-(thiophen-3-yl)hexanimidic acid
CID 3056599
3-Thiopheneacetamide, alpha-pentyl-
CID 3056600
3-Thiopheneacetamide, alpha,alpha-diallyl-
CID 3056602
Cyclopentanecarboxamide, 1-(3-thienyl)-
CID 3056604
Cyclohexanecarboxamide, 1-(3-thienyl)-
CID 3056605
3-Thiopheneacetamide, alpha,alpha-diethyl-
CID 3056606
3-Thiopheneacetamide, alpha,alpha-dipropyl-
CID 3056608

Frequently Asked Questions

What is the IUPAC name of 3-thiophen-3-ylpropanamide;hydrochloride?
The IUPAC name of 3-thiophen-3-ylpropanamide;hydrochloride (CID 69413122) is 3-thiophen-3-ylpropanamide;hydrochloride.
What is the SMILES notation for 3-thiophen-3-ylpropanamide;hydrochloride?
The canonical SMILES for 3-thiophen-3-ylpropanamide;hydrochloride is Cl.NC(=O)CCc1ccsc1.
What is the InChIKey of 3-thiophen-3-ylpropanamide;hydrochloride?
The InChIKey is QOMGTBBYUUGBNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NOS.ClH/c8-7(9)2-1-6-3-4-10-5-6;/h3-5H,1-2H2,(H2,8,9);1H.
What are the key properties of 3-thiophen-3-ylpropanamide;hydrochloride?
3-thiophen-3-ylpropanamide;hydrochloride has a molecular weight of 191.68 g/mol, XLogP of 1.59, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-thiophen-3-ylpropanamide;hydrochloride is sourced from PubChem (CID 69413122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).