cyclopentyl-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]methanone

C16H20N4O2 — CID 46270742

IUPACcyclopentyl-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]methanone
SMILESO=C(C1CCCC1)N1CCN(c2nc3cccnc3o2)CC1
InChIInChI=1S/C16H20N4O2/c21-15(12-4-1-2-5-12)19-8-10-20(11-9-19)16-18-13-6-3-7-17-14(13)22-16/h3,6-7,12H,1-2,4-5,8-11H2
InChIKeyDIVNLTAJZPVYMF-UHFFFAOYSA-N
MW300.36 g/mol
LogP2.06
Rot. Bonds2

About cyclopentyl-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]methanone

cyclopentyl-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]methanone (PubChem CID 46270742) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is cyclopentyl-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]methanone.

Molecular Properties

Compound Namecyclopentyl-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]methanone
PubChem CID46270742
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC Namecyclopentyl-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]methanone
SMILESO=C(C1CCCC1)N1CCN(c2nc3cccnc3o2)CC1
InChIInChI=1S/C16H20N4O2/c21-15(12-4-1-2-5-12)19-8-10-20(11-9-19)16-18-13-6-3-7-17-14(13)22-16/h3,6-7,12H,1-2,4-5,8-11H2
InChIKeyDIVNLTAJZPVYMF-UHFFFAOYSA-N
XLogP2.06
TPSA62.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[4-(4-Oxazolo[5,4-b]pyridin-2-yl-piperazin-1-yl)-pyrimidin-2-yl]-ethanol
CID 10881940
4-(6-PHENYL-OXAZOLO[5,4-b]PYRIDIN-2-YL)-1,4-DIAZA-BICYCLO[3.2.2]NONANE
CID 11162995
4-Oxazolo[5,4-b]pyridin-2-yl-1,4-diazabicyclo[3.2.2]nonane
CID 11447932
cis-(3,3-difluoropyrrolidin-1-yl)((2S,4S)-4-(4-(oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl)pyrrolidin-2-yl)methanone
CID 11596607
5-Fluoro-2-(1-methyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-yl)-[1,3]oxazolo[5,4-b]pyridine
CID 44552727
5-(5-fluoro-[1,3]oxazolo[5,4-b]pyridin-2-yl)-N,N-dimethylpyridin-2-amine
CID 44555284
2-(6-Chlorooxazolo[5,4-b]pyridin-2-yl)-2,5-diazabicyclo[3.2.2]-nonane
CID 46180746
2-(3-Fluorophenyl)-5-piperidin-1-yl-[1,3]oxazolo[5,4-b]pyridine
CID 71256288
2-(4-Fluorophenyl)-5-piperidin-1-yl-[1,3]oxazolo[5,4-b]pyridine
CID 71256332
(2-Butyl-1,3-benzoxazol-5-yl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone
CID 24819575
2-(1,4-Diazabicyclo[3.2.2]nonan-4-yl)-5-methyl-[1,3]oxazolo[5,4-b]pyridine
CID 46180747
2-(2-Fluorophenyl)-5-piperidin-1-yl-[1,3]oxazolo[5,4-b]pyridine
CID 71769421

Frequently Asked Questions

What is the IUPAC name of cyclopentyl-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]methanone?
The IUPAC name of cyclopentyl-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]methanone (CID 46270742) is cyclopentyl-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]methanone.
What is the SMILES notation for cyclopentyl-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]methanone?
The canonical SMILES for cyclopentyl-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]methanone is O=C(C1CCCC1)N1CCN(c2nc3cccnc3o2)CC1.
What is the InChIKey of cyclopentyl-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]methanone?
The InChIKey is DIVNLTAJZPVYMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c21-15(12-4-1-2-5-12)19-8-10-20(11-9-19)16-18-13-6-3-7-17-14(13)22-16/h3,6-7,12H,1-2,4-5,8-11H2.
What are the key properties of cyclopentyl-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]methanone?
cyclopentyl-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]methanone has a molecular weight of 300.36 g/mol, XLogP of 2.06, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]methanone is sourced from PubChem (CID 46270742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).