4-(diethylaminomethyl)thiophene-2-carboxamide

C10H16N2OS — CID 804148

IUPAC4-(diethylaminomethyl)thiophene-2-carboxamide
SMILESCCN(CC)Cc1csc(C(N)=O)c1
InChIInChI=1S/C10H16N2OS/c1-3-12(4-2)6-8-5-9(10(11)13)14-7-8/h5,7H,3-4,6H2,1-2H3,(H2,11,13)
InChIKeyFEOODGUQLGQOFT-UHFFFAOYSA-N
MW212.32 g/mol
LogP1.69
Rot. Bonds5

About 4-(diethylaminomethyl)thiophene-2-carboxamide

4-(diethylaminomethyl)thiophene-2-carboxamide (PubChem CID 804148) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 4-(diethylaminomethyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name4-(diethylaminomethyl)thiophene-2-carboxamide
PubChem CID804148
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name4-(diethylaminomethyl)thiophene-2-carboxamide
SMILESCCN(CC)Cc1csc(C(N)=O)c1
InChIInChI=1S/C10H16N2OS/c1-3-12(4-2)6-8-5-9(10(11)13)14-7-8/h5,7H,3-4,6H2,1-2H3,(H2,11,13)
InChIKeyFEOODGUQLGQOFT-UHFFFAOYSA-N
XLogP1.69
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(diethylaminomethyl)thiophene-2-carboxamide?
The IUPAC name of 4-(diethylaminomethyl)thiophene-2-carboxamide (CID 804148) is 4-(diethylaminomethyl)thiophene-2-carboxamide.
What is the SMILES notation for 4-(diethylaminomethyl)thiophene-2-carboxamide?
The canonical SMILES for 4-(diethylaminomethyl)thiophene-2-carboxamide is CCN(CC)Cc1csc(C(N)=O)c1.
What is the InChIKey of 4-(diethylaminomethyl)thiophene-2-carboxamide?
The InChIKey is FEOODGUQLGQOFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-3-12(4-2)6-8-5-9(10(11)13)14-7-8/h5,7H,3-4,6H2,1-2H3,(H2,11,13).
What are the key properties of 4-(diethylaminomethyl)thiophene-2-carboxamide?
4-(diethylaminomethyl)thiophene-2-carboxamide has a molecular weight of 212.32 g/mol, XLogP of 1.69, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(diethylaminomethyl)thiophene-2-carboxamide is sourced from PubChem (CID 804148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).