N-[2-(dimethylamino)ethyl]-1-thieno[3,2-c]pyridin-4-ylpiperidine-3-carboxamide

C17H24N4OS — CID 46396525

IUPACN-[2-(dimethylamino)ethyl]-1-thieno[3,2-c]pyridin-4-ylpiperidine-3-carboxamide
SMILESCN(C)CCNC(=O)C1CCCN(c2nccc3sccc23)C1
InChIInChI=1S/C17H24N4OS/c1-20(2)10-8-19-17(22)13-4-3-9-21(12-13)16-14-6-11-23-15(14)5-7-18-16/h5-7,11,13H,3-4,8-10,12H2,1-2H3,(H,19,22)
InChIKeyZCGGLIBWXUSKGX-UHFFFAOYSA-N
MW332.47 g/mol
LogP2.19
Rot. Bonds5

About N-[2-(dimethylamino)ethyl]-1-thieno[3,2-c]pyridin-4-ylpiperidine-3-carboxamide

N-[2-(dimethylamino)ethyl]-1-thieno[3,2-c]pyridin-4-ylpiperidine-3-carboxamide (PubChem CID 46396525) has the molecular formula C17H24N4OS and a molecular weight of 332.47 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-1-thieno[3,2-c]pyridin-4-ylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-1-thieno[3,2-c]pyridin-4-ylpiperidine-3-carboxamide
PubChem CID46396525
Molecular FormulaC17H24N4OS
Molecular Weight332.47 g/mol
Exact Mass332.17
IUPAC NameN-[2-(dimethylamino)ethyl]-1-thieno[3,2-c]pyridin-4-ylpiperidine-3-carboxamide
SMILESCN(C)CCNC(=O)C1CCCN(c2nccc3sccc23)C1
InChIInChI=1S/C17H24N4OS/c1-20(2)10-8-19-17(22)13-4-3-9-21(12-13)16-14-6-11-23-15(14)5-7-18-16/h5-7,11,13H,3-4,8-10,12H2,1-2H3,(H,19,22)
InChIKeyZCGGLIBWXUSKGX-UHFFFAOYSA-N
XLogP2.19
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.47
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-1-thieno[3,2-c]pyridin-4-ylpiperidine-3-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-1-thieno[3,2-c]pyridin-4-ylpiperidine-3-carboxamide (CID 46396525) is N-[2-(dimethylamino)ethyl]-1-thieno[3,2-c]pyridin-4-ylpiperidine-3-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-1-thieno[3,2-c]pyridin-4-ylpiperidine-3-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-1-thieno[3,2-c]pyridin-4-ylpiperidine-3-carboxamide is CN(C)CCNC(=O)C1CCCN(c2nccc3sccc23)C1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-1-thieno[3,2-c]pyridin-4-ylpiperidine-3-carboxamide?
The InChIKey is ZCGGLIBWXUSKGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4OS/c1-20(2)10-8-19-17(22)13-4-3-9-21(12-13)16-14-6-11-23-15(14)5-7-18-16/h5-7,11,13H,3-4,8-10,12H2,1-2H3,(H,19,22).
What are the key properties of N-[2-(dimethylamino)ethyl]-1-thieno[3,2-c]pyridin-4-ylpiperidine-3-carboxamide?
N-[2-(dimethylamino)ethyl]-1-thieno[3,2-c]pyridin-4-ylpiperidine-3-carboxamide has a molecular weight of 332.47 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-1-thieno[3,2-c]pyridin-4-ylpiperidine-3-carboxamide is sourced from PubChem (CID 46396525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).