N-[6-(diethylamino)-3-pyridinyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide

C17H22N4OS — CID 53498715

IUPACN-[6-(diethylamino)-3-pyridinyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
SMILESCCN(CC)c1ccc(NC(=O)N2CCc3sccc3C2)cn1
InChIInChI=1S/C17H22N4OS/c1-3-20(4-2)16-6-5-14(11-18-16)19-17(22)21-9-7-15-13(12-21)8-10-23-15/h5-6,8,10-11H,3-4,7,9,12H2,1-2H3,(H,19,22)
InChIKeyJIGPIGAZLMJKDC-UHFFFAOYSA-N
MW330.46 g/mol
LogP3.58
Rot. Bonds4

About N-[6-(diethylamino)-3-pyridinyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide

N-[6-(diethylamino)-3-pyridinyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide (PubChem CID 53498715) has the molecular formula C17H22N4OS and a molecular weight of 330.46 g/mol. Its IUPAC name is N-[6-(diethylamino)-3-pyridinyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide.

Molecular Properties

Compound NameN-[6-(diethylamino)-3-pyridinyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
PubChem CID53498715
Molecular FormulaC17H22N4OS
Molecular Weight330.46 g/mol
Exact Mass330.15
IUPAC NameN-[6-(diethylamino)-3-pyridinyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
SMILESCCN(CC)c1ccc(NC(=O)N2CCc3sccc3C2)cn1
InChIInChI=1S/C17H22N4OS/c1-3-20(4-2)16-6-5-14(11-18-16)19-17(22)21-9-7-15-13(12-21)8-10-23-15/h5-6,8,10-11H,3-4,7,9,12H2,1-2H3,(H,19,22)
InChIKeyJIGPIGAZLMJKDC-UHFFFAOYSA-N
XLogP3.58
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.46
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-sulfamoylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 24651018
N-[3-(1-methyl-1,2,4-triazol-3-yl)phenyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 122138815
N-[4-(diethylamino)phenyl]-2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetamide
CID 18137887
N-[4-(diethylamino)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide
CID 108989160
N-[(2R)-1-imidazol-1-ylpropan-2-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 94122779
3-(cyanomethyl)-N-[6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-3-pyridinyl]azetidine-1-carboxamide
CID 136553226
3-cyano-N-[6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-3-pyridinyl]azetidine-1-carboxamide
CID 167761494
N-(1-propan-2-yltriazol-4-yl)-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 72927590
N-[6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-3-pyridinyl]-2-methylsulfanylacetamide
CID 30896219
N-(3-acetamidopropyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 51077213
N-[2-(pyrimidin-2-ylamino)ethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 51084885
4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-(4-ethoxyphenyl)-4-oxobutanamide
CID 55883129

Frequently Asked Questions

What is the IUPAC name of N-[6-(diethylamino)-3-pyridinyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide?
The IUPAC name of N-[6-(diethylamino)-3-pyridinyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide (CID 53498715) is N-[6-(diethylamino)-3-pyridinyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide.
What is the SMILES notation for N-[6-(diethylamino)-3-pyridinyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide?
The canonical SMILES for N-[6-(diethylamino)-3-pyridinyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide is CCN(CC)c1ccc(NC(=O)N2CCc3sccc3C2)cn1.
What is the InChIKey of N-[6-(diethylamino)-3-pyridinyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide?
The InChIKey is JIGPIGAZLMJKDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4OS/c1-3-20(4-2)16-6-5-14(11-18-16)19-17(22)21-9-7-15-13(12-21)8-10-23-15/h5-6,8,10-11H,3-4,7,9,12H2,1-2H3,(H,19,22).
What are the key properties of N-[6-(diethylamino)-3-pyridinyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide?
N-[6-(diethylamino)-3-pyridinyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide has a molecular weight of 330.46 g/mol, XLogP of 3.58, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(diethylamino)-3-pyridinyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide is sourced from PubChem (CID 53498715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).