N-pentyl-1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carboxamide

C18H25N3OS — CID 46395507

IUPACN-pentyl-1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carboxamide
SMILESCCCCCNC(=O)C1CCN(c2nccc3sccc23)CC1
InChIInChI=1S/C18H25N3OS/c1-2-3-4-9-20-18(22)14-6-11-21(12-7-14)17-15-8-13-23-16(15)5-10-19-17/h5,8,10,13-14H,2-4,6-7,9,11-12H2,1H3,(H,20,22)
InChIKeyNVQYDJAWKUOELG-UHFFFAOYSA-N
MW331.48 g/mol
LogP3.82
Rot. Bonds6

About N-pentyl-1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carboxamide

N-pentyl-1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carboxamide (PubChem CID 46395507) has the molecular formula C18H25N3OS and a molecular weight of 331.48 g/mol. Its IUPAC name is N-pentyl-1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-pentyl-1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carboxamide
PubChem CID46395507
Molecular FormulaC18H25N3OS
Molecular Weight331.48 g/mol
Exact Mass331.17
IUPAC NameN-pentyl-1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carboxamide
SMILESCCCCCNC(=O)C1CCN(c2nccc3sccc23)CC1
InChIInChI=1S/C18H25N3OS/c1-2-3-4-9-20-18(22)14-6-11-21(12-7-14)17-15-8-13-23-16(15)5-10-19-17/h5,8,10,13-14H,2-4,6-7,9,11-12H2,1H3,(H,20,22)
InChIKeyNVQYDJAWKUOELG-UHFFFAOYSA-N
XLogP3.82
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.48
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[3-(2-methylpiperidin-1-yl)propyl]-1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carboxamide
CID 46395530
N-cyclopropyl-1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carboxamide
CID 163345555
N-(4-ethylphenyl)-1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carboxamide
CID 46395494
1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carboxamide
CID 155980991
N-butyl-1-thieno[3,2-d]pyrimidin-4-ylpiperidine-4-carboxamide
CID 36790347
(3S)-N-[(4-ethylphenyl)methyl]-1-thieno[3,2-c]pyridin-4-ylpiperidine-3-carboxamide
CID 92899054
(4,4-difluoropiperidin-1-yl)-(1-thieno[3,2-c]pyridin-4-ylpiperidin-4-yl)methanone
CID 163346052
N-cyclopentyl-2-(1-thieno[3,2-c]pyridin-4-ylpiperidin-4-yl)acetamide
CID 171994443
N-methyl-N-[(1-thieno[3,2-c]pyridin-4-ylpiperidin-4-yl)methyl]cyclobutanecarboxamide
CID 171335899
N-butyl-1-(2-chloro-4-pyridinyl)piperidine-4-carboxamide
CID 133373804
1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carbaldehyde
CID 55101087
N-pentyl-1-(5-phenylpyrimidin-2-yl)piperidine-4-carboxamide
CID 53107315

Frequently Asked Questions

What is the IUPAC name of N-pentyl-1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carboxamide?
The IUPAC name of N-pentyl-1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carboxamide (CID 46395507) is N-pentyl-1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carboxamide.
What is the SMILES notation for N-pentyl-1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carboxamide?
The canonical SMILES for N-pentyl-1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carboxamide is CCCCCNC(=O)C1CCN(c2nccc3sccc23)CC1.
What is the InChIKey of N-pentyl-1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carboxamide?
The InChIKey is NVQYDJAWKUOELG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3OS/c1-2-3-4-9-20-18(22)14-6-11-21(12-7-14)17-15-8-13-23-16(15)5-10-19-17/h5,8,10,13-14H,2-4,6-7,9,11-12H2,1H3,(H,20,22).
What are the key properties of N-pentyl-1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carboxamide?
N-pentyl-1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carboxamide has a molecular weight of 331.48 g/mol, XLogP of 3.82, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentyl-1-thieno[3,2-c]pyridin-4-ylpiperidine-4-carboxamide is sourced from PubChem (CID 46395507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).