1-(5-phenylthieno[3,2-b]pyridin-7-yl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide

C25H24N4OS — CID 18465159

IUPAC1-(5-phenylthieno[3,2-b]pyridin-7-yl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide
SMILESO=C(NCc1ccncc1)C1CCN(c2cc(-c3ccccc3)nc3ccsc23)CC1
InChIInChI=1S/C25H24N4OS/c30-25(27-17-18-6-11-26-12-7-18)20-8-13-29(14-9-20)23-16-22(19-4-2-1-3-5-19)28-21-10-15-31-24(21)23/h1-7,10-12,15-16,20H,8-9,13-14,17H2,(H,27,30)
InChIKeyGKMSVIHULDGFJV-UHFFFAOYSA-N
MW428.56 g/mol
LogP4.89
Rot. Bonds5

About 1-(5-phenylthieno[3,2-b]pyridin-7-yl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide

1-(5-phenylthieno[3,2-b]pyridin-7-yl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide (PubChem CID 18465159) has the molecular formula C25H24N4OS and a molecular weight of 428.56 g/mol. Its IUPAC name is 1-(5-phenylthieno[3,2-b]pyridin-7-yl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(5-phenylthieno[3,2-b]pyridin-7-yl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide
PubChem CID18465159
Molecular FormulaC25H24N4OS
Molecular Weight428.56 g/mol
Exact Mass428.17
IUPAC Name1-(5-phenylthieno[3,2-b]pyridin-7-yl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide
SMILESO=C(NCc1ccncc1)C1CCN(c2cc(-c3ccccc3)nc3ccsc23)CC1
InChIInChI=1S/C25H24N4OS/c30-25(27-17-18-6-11-26-12-7-18)20-8-13-29(14-9-20)23-16-22(19-4-2-1-3-5-19)28-21-10-15-31-24(21)23/h1-7,10-12,15-16,20H,8-9,13-14,17H2,(H,27,30)
InChIKeyGKMSVIHULDGFJV-UHFFFAOYSA-N
XLogP4.89
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.56
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(5-phenylthieno[3,2-b]pyridin-7-yl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide with MolForge

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Related Compounds

1-(5-pyridin-4-ylthieno[3,2-b]pyridin-7-yl)piperidine-4-carboxamide;hydrochloride
CID 70118258
N-(2-aminoethyl)-1-[5-(4-fluorophenyl)thieno[3,2-b]pyridin-7-yl]piperidine-4-carboxamide;hydrochloride
CID 70118666
ethyl 1-(5-phenylthieno[3,2-b]pyridin-7-yl)piperidine-4-carboxylate;hydrochloride
CID 70094420
1-(6-phenylpyrimidin-4-yl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide
CID 90519014
3-(2-fluorophenyl)-1-[1-(5-phenylthieno[3,2-b]pyridin-7-yl)piperidin-4-yl]propan-1-one
CID 18465162
N-[(4-fluorophenyl)methyl]-1-thieno[3,2-b]pyridin-7-ylpiperidine-4-carboxamide
CID 133318641
N-[(4-methylphenyl)methyl]-1-thieno[3,2-b]pyridin-7-ylpiperidine-4-carboxamide
CID 133356392
N-[(3-fluoro-4-methylphenyl)methyl]-1-thieno[3,2-b]pyridin-7-ylpiperidine-4-carboxamide
CID 133317132
1-[1-(2-phenylethyl)benzimidazol-2-yl]-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide
CID 46108688
N-[(4-methoxyphenyl)methyl]-1-(4-oxo-3-phenylthieno[3,2-d]pyrimidin-2-yl)piperidine-4-carboxamide
CID 50843225
N-benzyl-1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide
CID 133370734
N-[(3,4-dimethylphenyl)methyl]-1-(4-oxo-3-phenylthieno[3,2-d]pyrimidin-2-yl)piperidine-4-carboxamide
CID 50843123

Frequently Asked Questions

What is the IUPAC name of 1-(5-phenylthieno[3,2-b]pyridin-7-yl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide?
The IUPAC name of 1-(5-phenylthieno[3,2-b]pyridin-7-yl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide (CID 18465159) is 1-(5-phenylthieno[3,2-b]pyridin-7-yl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(5-phenylthieno[3,2-b]pyridin-7-yl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(5-phenylthieno[3,2-b]pyridin-7-yl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide is O=C(NCc1ccncc1)C1CCN(c2cc(-c3ccccc3)nc3ccsc23)CC1.
What is the InChIKey of 1-(5-phenylthieno[3,2-b]pyridin-7-yl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide?
The InChIKey is GKMSVIHULDGFJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N4OS/c30-25(27-17-18-6-11-26-12-7-18)20-8-13-29(14-9-20)23-16-22(19-4-2-1-3-5-19)28-21-10-15-31-24(21)23/h1-7,10-12,15-16,20H,8-9,13-14,17H2,(H,27,30).
What are the key properties of 1-(5-phenylthieno[3,2-b]pyridin-7-yl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide?
1-(5-phenylthieno[3,2-b]pyridin-7-yl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide has a molecular weight of 428.56 g/mol, XLogP of 4.89, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-phenylthieno[3,2-b]pyridin-7-yl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide is sourced from PubChem (CID 18465159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).