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

C17H18N4O2S — CID 20952024

IUPACN-(furan-2-ylmethyl)-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide
SMILESO=C(NCc1ccco1)C1CCN(c2nc3cccnc3s2)CC1
InChIInChI=1S/C17H18N4O2S/c22-15(19-11-13-3-2-10-23-13)12-5-8-21(9-6-12)17-20-14-4-1-7-18-16(14)24-17/h1-4,7,10,12H,5-6,8-9,11H2,(H,19,22)
InChIKeyPGTARPIHVVNPCN-UHFFFAOYSA-N
MW342.42 g/mol
LogP2.82
Rot. Bonds4

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

N-(furan-2-ylmethyl)-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide (PubChem CID 20952024) has the molecular formula C17H18N4O2S and a molecular weight of 342.42 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide
PubChem CID20952024
Molecular FormulaC17H18N4O2S
Molecular Weight342.42 g/mol
Exact Mass342.12
IUPAC NameN-(furan-2-ylmethyl)-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide
SMILESO=C(NCc1ccco1)C1CCN(c2nc3cccnc3s2)CC1
InChIInChI=1S/C17H18N4O2S/c22-15(19-11-13-3-2-10-23-13)12-5-8-21(9-6-12)17-20-14-4-1-7-18-16(14)24-17/h1-4,7,10,12H,5-6,8-9,11H2,(H,19,22)
InChIKeyPGTARPIHVVNPCN-UHFFFAOYSA-N
XLogP2.82
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.42
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide (CID 20952024) is N-(furan-2-ylmethyl)-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide is O=C(NCc1ccco1)C1CCN(c2nc3cccnc3s2)CC1.
What is the InChIKey of N-(furan-2-ylmethyl)-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide?
The InChIKey is PGTARPIHVVNPCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O2S/c22-15(19-11-13-3-2-10-23-13)12-5-8-21(9-6-12)17-20-14-4-1-7-18-16(14)24-17/h1-4,7,10,12H,5-6,8-9,11H2,(H,19,22).
What are the key properties of N-(furan-2-ylmethyl)-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide?
N-(furan-2-ylmethyl)-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide has a molecular weight of 342.42 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide is sourced from PubChem (CID 20952024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).