N-[2-(dimethylamino)ethyl]-4-ethyl-5-methylthiophene-3-carboxamide

C12H20N2OS — CID 1244058

IUPACN-[2-(dimethylamino)ethyl]-4-ethyl-5-methylthiophene-3-carboxamide
SMILESCCc1c(C(=O)NCCN(C)C)csc1C
InChIInChI=1S/C12H20N2OS/c1-5-10-9(2)16-8-11(10)12(15)13-6-7-14(3)4/h8H,5-7H2,1-4H3,(H,13,15)
InChIKeyQUEJPKVGVXODML-UHFFFAOYSA-N
MW240.37 g/mol
LogP1.91
Rot. Bonds5

About N-[2-(dimethylamino)ethyl]-4-ethyl-5-methylthiophene-3-carboxamide

N-[2-(dimethylamino)ethyl]-4-ethyl-5-methylthiophene-3-carboxamide (PubChem CID 1244058) has the molecular formula C12H20N2OS and a molecular weight of 240.37 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-4-ethyl-5-methylthiophene-3-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-4-ethyl-5-methylthiophene-3-carboxamide
PubChem CID1244058
Molecular FormulaC12H20N2OS
Molecular Weight240.37 g/mol
Exact Mass240.13
IUPAC NameN-[2-(dimethylamino)ethyl]-4-ethyl-5-methylthiophene-3-carboxamide
SMILESCCc1c(C(=O)NCCN(C)C)csc1C
InChIInChI=1S/C12H20N2OS/c1-5-10-9(2)16-8-11(10)12(15)13-6-7-14(3)4/h8H,5-7H2,1-4H3,(H,13,15)
InChIKeyQUEJPKVGVXODML-UHFFFAOYSA-N
XLogP1.91
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.37
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Silthiofam
CID 9881821
N-(2-ethylhexyl)-2-thiophenecarboxamide
CID 2915198
(4-Ethyl-5-methylthiophen-3-yl)(4-methyl-1,4-diazepan-1-yl)methanone
CID 6466910
N-[2-(dimethylamino)ethyl]-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxamide;hydrochloride
CID 16194528
N-[2-(dimethylamino)ethyl]-5-ethylthiophene-3-carboxamide
CID 1247079
N-[(1-ethylpyrrolidin-2-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CID 3241911
N-[3-(4-ethylpiperazin-1-yl)propyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
CID 3244633
N-(1-ethylpiperidin-3-yl)-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxamide
CID 3525907
N-propyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
CID 6618854
N-[2-[2-(dibutylamino)ethylamino]-2-oxoethyl]-2-thiophenecarboxamide
CID 9551015
N-{3-[butyl(ethyl)amino]propyl}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
CID 16193882
N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]thiophene-2-carboxamide
CID 18105320

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-4-ethyl-5-methylthiophene-3-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-4-ethyl-5-methylthiophene-3-carboxamide (CID 1244058) is N-[2-(dimethylamino)ethyl]-4-ethyl-5-methylthiophene-3-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-4-ethyl-5-methylthiophene-3-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-4-ethyl-5-methylthiophene-3-carboxamide is CCc1c(C(=O)NCCN(C)C)csc1C.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-4-ethyl-5-methylthiophene-3-carboxamide?
The InChIKey is QUEJPKVGVXODML-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2OS/c1-5-10-9(2)16-8-11(10)12(15)13-6-7-14(3)4/h8H,5-7H2,1-4H3,(H,13,15).
What are the key properties of N-[2-(dimethylamino)ethyl]-4-ethyl-5-methylthiophene-3-carboxamide?
N-[2-(dimethylamino)ethyl]-4-ethyl-5-methylthiophene-3-carboxamide has a molecular weight of 240.37 g/mol, XLogP of 1.91, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-4-ethyl-5-methylthiophene-3-carboxamide is sourced from PubChem (CID 1244058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).