N-(2-methyl-3-piperidin-1-ylpropyl)-2-(thiophene-2-carbonylamino)thiophene-3-carboxamide

C19H25N3O2S2 — CID 75463775

IUPACN-(2-methyl-3-piperidin-1-ylpropyl)-2-(thiophene-2-carbonylamino)thiophene-3-carboxamide
SMILESCC(CNC(=O)c1ccsc1NC(=O)c1cccs1)CN1CCCCC1
InChIInChI=1S/C19H25N3O2S2/c1-14(13-22-8-3-2-4-9-22)12-20-17(23)15-7-11-26-19(15)21-18(24)16-6-5-10-25-16/h5-7,10-11,14H,2-4,8-9,12-13H2,1H3,(H,20,23)(H,21,24)
InChIKeyGDEPXJWXSVSYFZ-UHFFFAOYSA-N
MW391.56 g/mol
LogP3.91
Rot. Bonds7

About N-(2-methyl-3-piperidin-1-ylpropyl)-2-(thiophene-2-carbonylamino)thiophene-3-carboxamide

N-(2-methyl-3-piperidin-1-ylpropyl)-2-(thiophene-2-carbonylamino)thiophene-3-carboxamide (PubChem CID 75463775) has the molecular formula C19H25N3O2S2 and a molecular weight of 391.56 g/mol. Its IUPAC name is N-(2-methyl-3-piperidin-1-ylpropyl)-2-(thiophene-2-carbonylamino)thiophene-3-carboxamide.

Molecular Properties

Compound NameN-(2-methyl-3-piperidin-1-ylpropyl)-2-(thiophene-2-carbonylamino)thiophene-3-carboxamide
PubChem CID75463775
Molecular FormulaC19H25N3O2S2
Molecular Weight391.56 g/mol
Exact Mass391.14
IUPAC NameN-(2-methyl-3-piperidin-1-ylpropyl)-2-(thiophene-2-carbonylamino)thiophene-3-carboxamide
SMILESCC(CNC(=O)c1ccsc1NC(=O)c1cccs1)CN1CCCCC1
InChIInChI=1S/C19H25N3O2S2/c1-14(13-22-8-3-2-4-9-22)12-20-17(23)15-7-11-26-19(15)21-18(24)16-6-5-10-25-16/h5-7,10-11,14H,2-4,8-9,12-13H2,1H3,(H,20,23)(H,21,24)
InChIKeyGDEPXJWXSVSYFZ-UHFFFAOYSA-N
XLogP3.91
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.56
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2R)-2-cyanopropyl]-2-(thiophene-2-carbonylamino)thiophene-3-carboxamide
CID 95979937
N-(2-methyl-3-piperidin-1-ylpropyl)-2-(thiophen-2-ylmethylsulfanyl)benzamide
CID 55979886
(2S)-N-(2-methyl-3-piperidin-1-ylpropyl)-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide
CID 55980543
N-(2-methyl-3-piperidin-1-ylpropyl)-5-thiophen-2-yl-1H-pyrazole-3-carboxamide
CID 55982510
3-bromo-N-(2-methyl-3-pyrrolidin-1-ylpropyl)thiophene-2-carboxamide
CID 55150022
2-bromo-N-(2-methyl-3-piperidin-1-ylpropyl)furan-3-carboxamide
CID 106853640
5-bromo-N-(2-methyl-3-piperidin-1-ylpropyl)thiophene-3-carboxamide
CID 54907003
N-(thian-4-ylmethyl)-2-(thiophene-2-carbonylamino)thiophene-3-carboxamide
CID 75463880
3-fluoro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-4-carboxamide
CID 115646380
methyl 2-(thiophene-2-carbonylamino)thiophene-3-carboxylate
CID 2808577
5-bromo-N-(2-methyl-3-pyrrolidin-1-ylpropyl)thiophene-3-carboxamide
CID 61061664
3-hydroxy-N-(2-methyl-3-pyrrolidin-1-ylpropyl)benzamide
CID 62992034

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-3-piperidin-1-ylpropyl)-2-(thiophene-2-carbonylamino)thiophene-3-carboxamide?
The IUPAC name of N-(2-methyl-3-piperidin-1-ylpropyl)-2-(thiophene-2-carbonylamino)thiophene-3-carboxamide (CID 75463775) is N-(2-methyl-3-piperidin-1-ylpropyl)-2-(thiophene-2-carbonylamino)thiophene-3-carboxamide.
What is the SMILES notation for N-(2-methyl-3-piperidin-1-ylpropyl)-2-(thiophene-2-carbonylamino)thiophene-3-carboxamide?
The canonical SMILES for N-(2-methyl-3-piperidin-1-ylpropyl)-2-(thiophene-2-carbonylamino)thiophene-3-carboxamide is CC(CNC(=O)c1ccsc1NC(=O)c1cccs1)CN1CCCCC1.
What is the InChIKey of N-(2-methyl-3-piperidin-1-ylpropyl)-2-(thiophene-2-carbonylamino)thiophene-3-carboxamide?
The InChIKey is GDEPXJWXSVSYFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2S2/c1-14(13-22-8-3-2-4-9-22)12-20-17(23)15-7-11-26-19(15)21-18(24)16-6-5-10-25-16/h5-7,10-11,14H,2-4,8-9,12-13H2,1H3,(H,20,23)(H,21,24).
What are the key properties of N-(2-methyl-3-piperidin-1-ylpropyl)-2-(thiophene-2-carbonylamino)thiophene-3-carboxamide?
N-(2-methyl-3-piperidin-1-ylpropyl)-2-(thiophene-2-carbonylamino)thiophene-3-carboxamide has a molecular weight of 391.56 g/mol, XLogP of 3.91, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-3-piperidin-1-ylpropyl)-2-(thiophene-2-carbonylamino)thiophene-3-carboxamide is sourced from PubChem (CID 75463775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).