1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-(2-phenoxyethyl)piperidine-3-carboxamide

C20H22N4O3 — CID 134791749

IUPAC1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-(2-phenoxyethyl)piperidine-3-carboxamide
SMILESO=C(NCCOc1ccccc1)C1CCCN(c2nc3ncccc3o2)C1
InChIInChI=1S/C20H22N4O3/c25-19(22-11-13-26-16-7-2-1-3-8-16)15-6-5-12-24(14-15)20-23-18-17(27-20)9-4-10-21-18/h1-4,7-10,15H,5-6,11-14H2,(H,22,25)
InChIKeyFXQZMUCOOULAEZ-UHFFFAOYSA-N
MW366.42 g/mol
LogP2.63
Rot. Bonds6

About 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-(2-phenoxyethyl)piperidine-3-carboxamide

1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-(2-phenoxyethyl)piperidine-3-carboxamide (PubChem CID 134791749) has the molecular formula C20H22N4O3 and a molecular weight of 366.42 g/mol. Its IUPAC name is 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-(2-phenoxyethyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-(2-phenoxyethyl)piperidine-3-carboxamide
PubChem CID134791749
Molecular FormulaC20H22N4O3
Molecular Weight366.42 g/mol
Exact Mass366.17
IUPAC Name1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-(2-phenoxyethyl)piperidine-3-carboxamide
SMILESO=C(NCCOc1ccccc1)C1CCCN(c2nc3ncccc3o2)C1
InChIInChI=1S/C20H22N4O3/c25-19(22-11-13-26-16-7-2-1-3-8-16)15-6-5-12-24(14-15)20-23-18-17(27-20)9-4-10-21-18/h1-4,7-10,15H,5-6,11-14H2,(H,22,25)
InChIKeyFXQZMUCOOULAEZ-UHFFFAOYSA-N
XLogP2.63
TPSA80.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 134794435
N-[2-(4-fluorophenyl)ethyl]-1-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperidine-3-carboxamide
CID 134792125
1-(1,3-benzoxazol-2-yl)-N-(3-ethoxypropyl)piperidine-3-carboxamide
CID 3654131
N-(2-phenoxyethyl)cyclopentanecarboxamide
CID 30349598
2-[1-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperidin-3-yl]-N-(2-pyrrolidin-1-ylethyl)acetamide
CID 154823410
N-(2-phenoxyethyl)-1-[6-(1,2,4-triazol-1-yl)pyrimidin-4-yl]piperidine-3-carboxamide
CID 71810880
1-(1,3-benzoxazol-2-yl)-N-benzylpiperidine-3-carboxamide
CID 3622789
N-(2-phenoxyethyl)cyclohexanecarboxamide
CID 2298971
1-(4-methylbenzoyl)-N-(2-phenoxyethyl)piperidine-3-carboxamide
CID 46481032
N-[2-(4-methylphenoxy)ethyl]-1-(6-methylpyridazin-3-yl)piperidine-3-carboxamide
CID 121118608
N-(2-phenylethyl)-1-pyrimidin-2-ylpiperidine-3-carboxamide
CID 3221429
6-chloro-N-[1-([1,3]oxazolo[4,5-b]pyridin-2-yl)piperidin-3-yl]pyridine-3-carboxamide
CID 134795266

Frequently Asked Questions

What is the IUPAC name of 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-(2-phenoxyethyl)piperidine-3-carboxamide?
The IUPAC name of 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-(2-phenoxyethyl)piperidine-3-carboxamide (CID 134791749) is 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-(2-phenoxyethyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-(2-phenoxyethyl)piperidine-3-carboxamide?
The canonical SMILES for 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-(2-phenoxyethyl)piperidine-3-carboxamide is O=C(NCCOc1ccccc1)C1CCCN(c2nc3ncccc3o2)C1.
What is the InChIKey of 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-(2-phenoxyethyl)piperidine-3-carboxamide?
The InChIKey is FXQZMUCOOULAEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O3/c25-19(22-11-13-26-16-7-2-1-3-8-16)15-6-5-12-24(14-15)20-23-18-17(27-20)9-4-10-21-18/h1-4,7-10,15H,5-6,11-14H2,(H,22,25).
What are the key properties of 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-(2-phenoxyethyl)piperidine-3-carboxamide?
1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-(2-phenoxyethyl)piperidine-3-carboxamide has a molecular weight of 366.42 g/mol, XLogP of 2.63, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-([1,3]oxazolo[4,5-b]pyridin-2-yl)-N-(2-phenoxyethyl)piperidine-3-carboxamide is sourced from PubChem (CID 134791749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).