3-cyclopropyl-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]thiophene-2-carboxamide

C16H20N2OS2 — CID 95139013

IUPAC3-cyclopropyl-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]thiophene-2-carboxamide
SMILESCN(C)[C@H](CNC(=O)c1sccc1C1CC1)c1cccs1
InChIInChI=1S/C16H20N2OS2/c1-18(2)13(14-4-3-8-20-14)10-17-16(19)15-12(7-9-21-15)11-5-6-11/h3-4,7-9,11,13H,5-6,10H2,1-2H3,(H,17,19)/t13-/m1/s1
InChIKeyHUINDHJFQBQSBO-CYBMUJFWSA-N
MW320.48 g/mol
LogP3.72
Rot. Bonds6

About 3-cyclopropyl-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]thiophene-2-carboxamide

3-cyclopropyl-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]thiophene-2-carboxamide (PubChem CID 95139013) has the molecular formula C16H20N2OS2 and a molecular weight of 320.48 g/mol. Its IUPAC name is 3-cyclopropyl-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]thiophene-2-carboxamide.

Molecular Properties

Compound Name3-cyclopropyl-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]thiophene-2-carboxamide
PubChem CID95139013
Molecular FormulaC16H20N2OS2
Molecular Weight320.48 g/mol
Exact Mass320.10
IUPAC Name3-cyclopropyl-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]thiophene-2-carboxamide
SMILESCN(C)[C@H](CNC(=O)c1sccc1C1CC1)c1cccs1
InChIInChI=1S/C16H20N2OS2/c1-18(2)13(14-4-3-8-20-14)10-17-16(19)15-12(7-9-21-15)11-5-6-11/h3-4,7-9,11,13H,5-6,10H2,1-2H3,(H,17,19)/t13-/m1/s1
InChIKeyHUINDHJFQBQSBO-CYBMUJFWSA-N
XLogP3.72
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.48
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-cyclopropyl-N-[2-(methylamino)propyl]thiophene-2-carboxamide
CID 120828095
N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide
CID 51710563
N-[(2S)-2-(dimethylamino)-2-thiophen-2-ylethyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide
CID 93482434
2-cyclohexyl-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide
CID 46522897
N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]-5-methylpyrazine-2-carboxamide
CID 30531933
1-cyclohexyl-3-[(2S)-2-(dimethylamino)-2-thiophen-2-ylethyl]urea
CID 30834300
N-[(2S)-2-(dimethylamino)-2-thiophen-2-ylethyl]-2-(4-fluorophenyl)acetamide
CID 30834307
2-bromo-N-[(2S)-2-(dimethylamino)-2-thiophen-2-ylethyl]benzamide
CID 8504392
N-[(2S)-2-(dimethylamino)-2-thiophen-2-ylethyl]-2,6-dimethoxybenzamide
CID 30834274
2-(4-chlorophenyl)-N-[(2S)-2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide
CID 30834281
N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-2-fluorobenzamide
CID 18161749
3-cyclopropyl-N-methylthiophene-2-carboxamide
CID 130634247

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]thiophene-2-carboxamide?
The IUPAC name of 3-cyclopropyl-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]thiophene-2-carboxamide (CID 95139013) is 3-cyclopropyl-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]thiophene-2-carboxamide.
What is the SMILES notation for 3-cyclopropyl-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]thiophene-2-carboxamide?
The canonical SMILES for 3-cyclopropyl-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]thiophene-2-carboxamide is CN(C)[C@H](CNC(=O)c1sccc1C1CC1)c1cccs1.
What is the InChIKey of 3-cyclopropyl-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]thiophene-2-carboxamide?
The InChIKey is HUINDHJFQBQSBO-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H20N2OS2/c1-18(2)13(14-4-3-8-20-14)10-17-16(19)15-12(7-9-21-15)11-5-6-11/h3-4,7-9,11,13H,5-6,10H2,1-2H3,(H,17,19)/t13-/m1/s1.
What are the key properties of 3-cyclopropyl-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]thiophene-2-carboxamide?
3-cyclopropyl-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]thiophene-2-carboxamide has a molecular weight of 320.48 g/mol, XLogP of 3.72, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]thiophene-2-carboxamide is sourced from PubChem (CID 95139013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).