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

C19H23N5O2S — CID 20952056

IUPACN-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide
SMILESCc1noc(C)c1CCNC(=O)C1CCN(c2nc3cccnc3s2)CC1
InChIInChI=1S/C19H23N5O2S/c1-12-15(13(2)26-23-12)5-9-20-17(25)14-6-10-24(11-7-14)19-22-16-4-3-8-21-18(16)27-19/h3-4,8,14H,5-7,9-11H2,1-2H3,(H,20,25)
InChIKeyWRYSTMYZHXRGQH-UHFFFAOYSA-N
MW385.49 g/mol
LogP2.87
Rot. Bonds5

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

N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide (PubChem CID 20952056) has the molecular formula C19H23N5O2S and a molecular weight of 385.49 g/mol. Its IUPAC name is N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide
PubChem CID20952056
Molecular FormulaC19H23N5O2S
Molecular Weight385.49 g/mol
Exact Mass385.16
IUPAC NameN-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide
SMILESCc1noc(C)c1CCNC(=O)C1CCN(c2nc3cccnc3s2)CC1
InChIInChI=1S/C19H23N5O2S/c1-12-15(13(2)26-23-12)5-9-20-17(25)14-6-10-24(11-7-14)19-22-16-4-3-8-21-18(16)27-19/h3-4,8,14H,5-7,9-11H2,1-2H3,(H,20,25)
InChIKeyWRYSTMYZHXRGQH-UHFFFAOYSA-N
XLogP2.87
TPSA84.15 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.49
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide?
The IUPAC name of N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide (CID 20952056) is N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide.
What is the SMILES notation for N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide?
The canonical SMILES for N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide is Cc1noc(C)c1CCNC(=O)C1CCN(c2nc3cccnc3s2)CC1.
What is the InChIKey of N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide?
The InChIKey is WRYSTMYZHXRGQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O2S/c1-12-15(13(2)26-23-12)5-9-20-17(25)14-6-10-24(11-7-14)19-22-16-4-3-8-21-18(16)27-19/h3-4,8,14H,5-7,9-11H2,1-2H3,(H,20,25).
What are the key properties of N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide?
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide has a molecular weight of 385.49 g/mol, XLogP of 2.87, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-4-carboxamide is sourced from PubChem (CID 20952056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).