(Z)-3-(5-propylthiophen-2-yl)prop-2-enamide

C10H13NOS — CID 55267151

IUPAC(Z)-3-(5-propylthiophen-2-yl)prop-2-enamide
SMILESCCCc1ccc(/C=C\C(N)=O)s1
InChIInChI=1S/C10H13NOS/c1-2-3-8-4-5-9(13-8)6-7-10(11)12/h4-7H,2-3H2,1H3,(H2,11,12)/b7-6-
InChIKeyPQHQOCKTNDLUNZ-SREVYHEPSA-N
MW195.29 g/mol
LogP2.20
Rot. Bonds4

About (Z)-3-(5-propylthiophen-2-yl)prop-2-enamide

(Z)-3-(5-propylthiophen-2-yl)prop-2-enamide (PubChem CID 55267151) has the molecular formula C10H13NOS and a molecular weight of 195.29 g/mol. Its IUPAC name is (Z)-3-(5-propylthiophen-2-yl)prop-2-enamide.

Molecular Properties

Compound Name(Z)-3-(5-propylthiophen-2-yl)prop-2-enamide
PubChem CID55267151
Molecular FormulaC10H13NOS
Molecular Weight195.29 g/mol
Exact Mass195.07
IUPAC Name(Z)-3-(5-propylthiophen-2-yl)prop-2-enamide
SMILESCCCc1ccc(/C=C\C(N)=O)s1
InChIInChI=1S/C10H13NOS/c1-2-3-8-4-5-9(13-8)6-7-10(11)12/h4-7H,2-3H2,1H3,(H2,11,12)/b7-6-
InChIKeyPQHQOCKTNDLUNZ-SREVYHEPSA-N
XLogP2.20
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.29
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze (Z)-3-(5-propylthiophen-2-yl)prop-2-enamide 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 (Z)-3-(5-propylthiophen-2-yl)prop-2-enamide?
The IUPAC name of (Z)-3-(5-propylthiophen-2-yl)prop-2-enamide (CID 55267151) is (Z)-3-(5-propylthiophen-2-yl)prop-2-enamide.
What is the SMILES notation for (Z)-3-(5-propylthiophen-2-yl)prop-2-enamide?
The canonical SMILES for (Z)-3-(5-propylthiophen-2-yl)prop-2-enamide is CCCc1ccc(/C=C\C(N)=O)s1.
What is the InChIKey of (Z)-3-(5-propylthiophen-2-yl)prop-2-enamide?
The InChIKey is PQHQOCKTNDLUNZ-SREVYHEPSA-N. The full InChI is InChI=1S/C10H13NOS/c1-2-3-8-4-5-9(13-8)6-7-10(11)12/h4-7H,2-3H2,1H3,(H2,11,12)/b7-6-.
What are the key properties of (Z)-3-(5-propylthiophen-2-yl)prop-2-enamide?
(Z)-3-(5-propylthiophen-2-yl)prop-2-enamide has a molecular weight of 195.29 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-(5-propylthiophen-2-yl)prop-2-enamide is sourced from PubChem (CID 55267151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).