N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-3-cyclopropylthieno[3,2-b]pyridine-5-carboxamide

C21H23N5OS — CID 118644346

IUPACN-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-3-cyclopropylthieno[3,2-b]pyridine-5-carboxamide
SMILESNC1CCCN(c2ccncc2NC(=O)c2ccc3scc(C4CC4)c3n2)C1
InChIInChI=1S/C21H23N5OS/c22-14-2-1-9-26(11-14)18-7-8-23-10-17(18)25-21(27)16-5-6-19-20(24-16)15(12-28-19)13-3-4-13/h5-8,10,12-14H,1-4,9,11,22H2,(H,25,27)
InChIKeyNUPKHEWMUIGXFB-UHFFFAOYSA-N
MW393.52 g/mol
LogP3.75
Rot. Bonds4

About N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-3-cyclopropylthieno[3,2-b]pyridine-5-carboxamide

N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-3-cyclopropylthieno[3,2-b]pyridine-5-carboxamide (PubChem CID 118644346) has the molecular formula C21H23N5OS and a molecular weight of 393.52 g/mol. Its IUPAC name is N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-3-cyclopropylthieno[3,2-b]pyridine-5-carboxamide.

Molecular Properties

Compound NameN-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-3-cyclopropylthieno[3,2-b]pyridine-5-carboxamide
PubChem CID118644346
Molecular FormulaC21H23N5OS
Molecular Weight393.52 g/mol
Exact Mass393.16
IUPAC NameN-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-3-cyclopropylthieno[3,2-b]pyridine-5-carboxamide
SMILESNC1CCCN(c2ccncc2NC(=O)c2ccc3scc(C4CC4)c3n2)C1
InChIInChI=1S/C21H23N5OS/c22-14-2-1-9-26(11-14)18-7-8-23-10-17(18)25-21(27)16-5-6-19-20(24-16)15(12-28-19)13-3-4-13/h5-8,10,12-14H,1-4,9,11,22H2,(H,25,27)
InChIKeyNUPKHEWMUIGXFB-UHFFFAOYSA-N
XLogP3.75
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.52
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-3-cyclopropylthieno[3,2-b]pyridine-5-carboxamide with MolForge

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Related Compounds

N-[4-[(3S)-3-aminopiperidin-1-yl]-3-pyridinyl]-3-ethylthieno[3,2-b]pyridine-5-carboxamide
CID 118644369
N-[4-[(3S)-3-aminopiperidin-1-yl]-3-pyridinyl]-2-indazol-1-yl-1,3-thiazole-4-carboxamide
CID 59332076
N-[4-[(3S,5R)-3-amino-5-methylpiperidin-1-yl]-3-pyridinyl]-2-cyclopropylthieno[3,2-b]pyridine-5-carboxamide
CID 118644388
N-[4-[(3S,5R)-3-amino-5-methylpiperidin-1-yl]-3-pyridinyl]-3-(1-methylpyrazol-4-yl)thieno[3,2-b]pyridine-5-carboxamide
CID 118644415
N-[3-[(3R)-3-aminopiperidin-1-yl]-4-pyridinyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide
CID 56967893
N-[4-[(3S,5R)-3-amino-5-methylpiperidin-1-yl]-3-pyridinyl]-3-(2,6-difluoro-3-methoxyphenyl)thieno[3,2-b]pyridine-5-carboxamide
CID 118644365
5-amino-N-[4-[(3S)-3-aminopiperidin-1-yl]-3-pyridinyl]-2-phenyl-1,3-thiazole-4-carboxamide
CID 51002498
3-amino-N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-6-(4-methylthiophen-2-yl)pyridine-2-carboxamide
CID 77420686
3-amino-N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-6-(5-thiophen-2-ylthiophen-2-yl)pyridine-2-carboxamide
CID 77420803
5-amino-N-[4-[(3S)-3-aminopiperidin-1-yl]-3-pyridinyl]-2-benzyl-1,3-thiazole-4-carboxamide
CID 51001945
6-(1-adamantyl)-3-amino-N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]pyridine-2-carboxamide
CID 77419838
5-amino-N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-2-(2,6-difluorophenyl)-1,3-thiazole-4-carboxamide
CID 67499805

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-3-cyclopropylthieno[3,2-b]pyridine-5-carboxamide?
The IUPAC name of N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-3-cyclopropylthieno[3,2-b]pyridine-5-carboxamide (CID 118644346) is N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-3-cyclopropylthieno[3,2-b]pyridine-5-carboxamide.
What is the SMILES notation for N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-3-cyclopropylthieno[3,2-b]pyridine-5-carboxamide?
The canonical SMILES for N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-3-cyclopropylthieno[3,2-b]pyridine-5-carboxamide is NC1CCCN(c2ccncc2NC(=O)c2ccc3scc(C4CC4)c3n2)C1.
What is the InChIKey of N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-3-cyclopropylthieno[3,2-b]pyridine-5-carboxamide?
The InChIKey is NUPKHEWMUIGXFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N5OS/c22-14-2-1-9-26(11-14)18-7-8-23-10-17(18)25-21(27)16-5-6-19-20(24-16)15(12-28-19)13-3-4-13/h5-8,10,12-14H,1-4,9,11,22H2,(H,25,27).
What are the key properties of N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-3-cyclopropylthieno[3,2-b]pyridine-5-carboxamide?
N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-3-cyclopropylthieno[3,2-b]pyridine-5-carboxamide has a molecular weight of 393.52 g/mol, XLogP of 3.75, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-aminopiperidin-1-yl)-3-pyridinyl]-3-cyclopropylthieno[3,2-b]pyridine-5-carboxamide is sourced from PubChem (CID 118644346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).