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

C18H20N4O2S — CID 20952107

IUPACN-[2-(furan-2-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide
SMILESO=C(NCCc1ccco1)C1CCN(c2nc3cccnc3s2)CC1
InChIInChI=1S/C18H20N4O2S/c23-16(19-9-5-14-3-2-12-24-14)13-6-10-22(11-7-13)18-21-15-4-1-8-20-17(15)25-18/h1-4,8,12-13H,5-7,9-11H2,(H,19,23)
InChIKeyFSVLBVFMTOKHKQ-UHFFFAOYSA-N
MW356.45 g/mol
LogP2.86
Rot. Bonds5

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

N-[2-(furan-2-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide (PubChem CID 20952107) has the molecular formula C18H20N4O2S and a molecular weight of 356.45 g/mol. Its IUPAC name is N-[2-(furan-2-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(furan-2-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide
PubChem CID20952107
Molecular FormulaC18H20N4O2S
Molecular Weight356.45 g/mol
Exact Mass356.13
IUPAC NameN-[2-(furan-2-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide
SMILESO=C(NCCc1ccco1)C1CCN(c2nc3cccnc3s2)CC1
InChIInChI=1S/C18H20N4O2S/c23-16(19-9-5-14-3-2-12-24-14)13-6-10-22(11-7-13)18-21-15-4-1-8-20-17(15)25-18/h1-4,8,12-13H,5-7,9-11H2,(H,19,23)
InChIKeyFSVLBVFMTOKHKQ-UHFFFAOYSA-N
XLogP2.86
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.45
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(furan-2-yl)-5-N-(2-pyridin-3-ylethyl)-[1,3]thiazolo[5,4-d]pyrimidine-5,7-diamine
CID 145436763
5-N-(furan-2-yl)-2-(pyridin-3-ylmethyl)-[1,3]thiazolo[5,4-d]pyrimidine-5,7-diamine
CID 168274325
N-(5-methoxy-[1,3]thiazolo[5,4-b]pyridin-2-yl)pyridine-4-carboxamide
CID 56592907
4-{[2-(Benzylsulfanyl)-3H-imidazo[4,5-B]pyridin-3-YL]methyl}-N-[2-(furan-2-YL)ethyl]benzamide
CID 20887415
4-{[2-(Benzylsulfanyl)-3H-imidazo[4,5-B]pyridin-3-YL]methyl}-N-[3-(furan-2-YL)propyl]benzamide
CID 20887421
N-[(3-Methoxyphenyl)methyl]-1-{[1,3]thiazolo[5,4-B]pyridin-2-YL}piperidine-4-carboxamide
CID 20888395
1-(Furan-2-carbonyl)-4-(1-{[1,3]thiazolo[5,4-B]pyridin-2-YL}piperidine-4-carbonyl)piperazine
CID 20952004
N-[(Furan-2-YL)methyl]-1-{[1,3]thiazolo[5,4-B]pyridin-2-YL}piperidine-4-carboxamide
CID 20952024
N-[(4-Methoxyphenyl)methyl]-1-{[1,3]thiazolo[5,4-B]pyridin-2-YL}piperidine-4-carboxamide
CID 20952025
N-[(2-Methoxyphenyl)methyl]-1-{[1,3]thiazolo[5,4-B]pyridin-2-YL}piperidine-4-carboxamide
CID 20952037
N-[(5-Methylfuran-2-YL)methyl]-1-{[1,3]thiazolo[5,4-B]pyridin-2-YL}piperidine-4-carboxamide
CID 20952048
N-[(2-ethoxyphenyl)methyl]-1-{[1,3]thiazolo[5,4-b]pyridin-2-yl}piperidine-4-carboxamide
CID 20952078

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide?
The IUPAC name of N-[2-(furan-2-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide (CID 20952107) is N-[2-(furan-2-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide.
What is the SMILES notation for N-[2-(furan-2-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide?
The canonical SMILES for N-[2-(furan-2-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide is O=C(NCCc1ccco1)C1CCN(c2nc3cccnc3s2)CC1.
What is the InChIKey of N-[2-(furan-2-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide?
The InChIKey is FSVLBVFMTOKHKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O2S/c23-16(19-9-5-14-3-2-12-24-14)13-6-10-22(11-7-13)18-21-15-4-1-8-20-17(15)25-18/h1-4,8,12-13H,5-7,9-11H2,(H,19,23).
What are the key properties of N-[2-(furan-2-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide?
N-[2-(furan-2-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide has a molecular weight of 356.45 g/mol, XLogP of 2.86, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide is sourced from PubChem (CID 20952107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).