3-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-carboxamide

C11H19N3OS — CID 63694246

IUPAC3-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-carboxamide
SMILESCN(C)CCCN(C)C(=O)c1sccc1N
InChIInChI=1S/C11H19N3OS/c1-13(2)6-4-7-14(3)11(15)10-9(12)5-8-16-10/h5,8H,4,6-7,12H2,1-3H3
InChIKeyLTICMKMCGRUGLK-UHFFFAOYSA-N
MW241.36 g/mol
LogP1.35
Rot. Bonds5

About 3-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-carboxamide

3-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-carboxamide (PubChem CID 63694246) has the molecular formula C11H19N3OS and a molecular weight of 241.36 g/mol. Its IUPAC name is 3-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-carboxamide
PubChem CID63694246
Molecular FormulaC11H19N3OS
Molecular Weight241.36 g/mol
Exact Mass241.12
IUPAC Name3-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-carboxamide
SMILESCN(C)CCCN(C)C(=O)c1sccc1N
InChIInChI=1S/C11H19N3OS/c1-13(2)6-4-7-14(3)11(15)10-9(12)5-8-16-10/h5,8H,4,6-7,12H2,1-3H3
InChIKeyLTICMKMCGRUGLK-UHFFFAOYSA-N
XLogP1.35
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.36
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-methyl-N-propylthiophene-2-carboxamide
CID 61095360
3-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-methylthiophene-2-carboxamide
CID 61095580
3-amino-N,N-dimethylthiophene-2-carboxamide
CID 61092296
3-amino-N-[2-(4-chlorophenoxy)ethyl]-N-methylthiophene-2-carboxamide
CID 61114488
4-amino-N-[3-(dimethylamino)propyl]-N-methylbenzamide
CID 22567507
3-amino-N-(2-cyanopropyl)-N-methylthiophene-2-carboxamide
CID 61114368
3-amino-N-methyl-N-[(2-methylphenyl)methyl]thiophene-2-carboxamide
CID 61094457
N-butyl-N,3-dimethylthiophene-2-carboxamide
CID 86978133
3-amino-N-ethyl-N-propylthiophene-2-carboxamide
CID 61095166
2-amino-N-[3-(dimethylamino)propyl]-N-methyl-1,3-thiazole-4-carboxamide
CID 63692953
3-amino-N-[2-(3-chlorophenoxy)ethyl]-N-methylthiophene-2-carboxamide
CID 61138440
3-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylthiophene-2-carboxamide
CID 61093482

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-carboxamide?
The IUPAC name of 3-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-carboxamide (CID 63694246) is 3-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-carboxamide.
What is the SMILES notation for 3-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-carboxamide?
The canonical SMILES for 3-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-carboxamide is CN(C)CCCN(C)C(=O)c1sccc1N.
What is the InChIKey of 3-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-carboxamide?
The InChIKey is LTICMKMCGRUGLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3OS/c1-13(2)6-4-7-14(3)11(15)10-9(12)5-8-16-10/h5,8H,4,6-7,12H2,1-3H3.
What are the key properties of 3-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-carboxamide?
3-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-carboxamide has a molecular weight of 241.36 g/mol, XLogP of 1.35, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-carboxamide is sourced from PubChem (CID 63694246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).