2-amino-N,N-diethyl-5-propan-2-ylthiophene-3-carboxamide

C12H20N2OS — CID 43367305

IUPAC2-amino-N,N-diethyl-5-propan-2-ylthiophene-3-carboxamide
SMILESCCN(CC)C(=O)c1cc(C(C)C)sc1N
InChIInChI=1S/C12H20N2OS/c1-5-14(6-2)12(15)9-7-10(8(3)4)16-11(9)13/h7-8H,5-6,13H2,1-4H3
InChIKeyVZPFGRQINIPNQY-UHFFFAOYSA-N
MW240.37 g/mol
LogP2.94
Rot. Bonds4

About 2-amino-N,N-diethyl-5-propan-2-ylthiophene-3-carboxamide

2-amino-N,N-diethyl-5-propan-2-ylthiophene-3-carboxamide (PubChem CID 43367305) has the molecular formula C12H20N2OS and a molecular weight of 240.37 g/mol. Its IUPAC name is 2-amino-N,N-diethyl-5-propan-2-ylthiophene-3-carboxamide.

Molecular Properties

Compound Name2-amino-N,N-diethyl-5-propan-2-ylthiophene-3-carboxamide
PubChem CID43367305
Molecular FormulaC12H20N2OS
Molecular Weight240.37 g/mol
Exact Mass240.13
IUPAC Name2-amino-N,N-diethyl-5-propan-2-ylthiophene-3-carboxamide
SMILESCCN(CC)C(=O)c1cc(C(C)C)sc1N
InChIInChI=1S/C12H20N2OS/c1-5-14(6-2)12(15)9-7-10(8(3)4)16-11(9)13/h7-8H,5-6,13H2,1-4H3
InChIKeyVZPFGRQINIPNQY-UHFFFAOYSA-N
XLogP2.94
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.37
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N,N-diethyl-5-methylthiophene-3-carboxamide
CID 43367307
2-amino-N,5-di(propan-2-yl)thiophene-3-carboxamide
CID 43174802
(2-amino-5-propan-2-ylthiophen-3-yl)-pyrrolidin-1-ylmethanone
CID 43367331
4,5-dichloro-1-N,1-N,2-N,2-N-tetraethylbenzene-1,2-dicarboxamide
CID 23857395
2,5-dibromo-N,N-diethylthiophene-3-carboxamide
CID 103672324
N,N-diethyl-3,5-di(propan-2-yl)benzamide
CID 71210847
2-amino-N,N-diethyl-4,5-dimethoxybenzamide
CID 16776188
2,4-dichloro-N,N-diethyl-5-sulfamoylbenzamide
CID 60635894
2-amino-4-chloro-N,N-diethylbenzamide
CID 16773722
5-amino-N,N-diethyl-2-(2-methylpropoxy)benzamide
CID 134821733
5-amino-N-ethyl-2-methyl-N-(2-methylpropyl)pyridine-3-carboxamide
CID 61040071
5-amino-N,N-diethyl-2-fluoro-3-methylbenzamide
CID 103295681

Frequently Asked Questions

What is the IUPAC name of 2-amino-N,N-diethyl-5-propan-2-ylthiophene-3-carboxamide?
The IUPAC name of 2-amino-N,N-diethyl-5-propan-2-ylthiophene-3-carboxamide (CID 43367305) is 2-amino-N,N-diethyl-5-propan-2-ylthiophene-3-carboxamide.
What is the SMILES notation for 2-amino-N,N-diethyl-5-propan-2-ylthiophene-3-carboxamide?
The canonical SMILES for 2-amino-N,N-diethyl-5-propan-2-ylthiophene-3-carboxamide is CCN(CC)C(=O)c1cc(C(C)C)sc1N.
What is the InChIKey of 2-amino-N,N-diethyl-5-propan-2-ylthiophene-3-carboxamide?
The InChIKey is VZPFGRQINIPNQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2OS/c1-5-14(6-2)12(15)9-7-10(8(3)4)16-11(9)13/h7-8H,5-6,13H2,1-4H3.
What are the key properties of 2-amino-N,N-diethyl-5-propan-2-ylthiophene-3-carboxamide?
2-amino-N,N-diethyl-5-propan-2-ylthiophene-3-carboxamide has a molecular weight of 240.37 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N,N-diethyl-5-propan-2-ylthiophene-3-carboxamide is sourced from PubChem (CID 43367305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).