5-[7-(piperidine-1-carbonyl)-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl]-1,2-dihydropyridine-2-carboxamide

C19H23N5O3 — CID 166886679

IUPAC5-[7-(piperidine-1-carbonyl)-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl]-1,2-dihydropyridine-2-carboxamide
SMILESNC(=O)C1C=CC(N2CCOc3cc(C(=O)N4CCCCC4)cnc32)=CN1
InChIInChI=1S/C19H23N5O3/c20-17(25)15-5-4-14(12-21-15)24-8-9-27-16-10-13(11-22-18(16)24)19(26)23-6-2-1-3-7-23/h4-5,10-12,15,21H,1-3,6-9H2,(H2,20,25)
InChIKeyIMQYZAVOWUIYQQ-UHFFFAOYSA-N
MW369.43 g/mol
LogP0.76
Rot. Bonds3

About 5-[7-(piperidine-1-carbonyl)-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl]-1,2-dihydropyridine-2-carboxamide

5-[7-(piperidine-1-carbonyl)-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl]-1,2-dihydropyridine-2-carboxamide (PubChem CID 166886679) has the molecular formula C19H23N5O3 and a molecular weight of 369.43 g/mol. Its IUPAC name is 5-[7-(piperidine-1-carbonyl)-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl]-1,2-dihydropyridine-2-carboxamide.

Molecular Properties

Compound Name5-[7-(piperidine-1-carbonyl)-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl]-1,2-dihydropyridine-2-carboxamide
PubChem CID166886679
Molecular FormulaC19H23N5O3
Molecular Weight369.43 g/mol
Exact Mass369.18
IUPAC Name5-[7-(piperidine-1-carbonyl)-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl]-1,2-dihydropyridine-2-carboxamide
SMILESNC(=O)C1C=CC(N2CCOc3cc(C(=O)N4CCCCC4)cnc32)=CN1
InChIInChI=1S/C19H23N5O3/c20-17(25)15-5-4-14(12-21-15)24-8-9-27-16-10-13(11-22-18(16)24)19(26)23-6-2-1-3-7-23/h4-5,10-12,15,21H,1-3,6-9H2,(H2,20,25)
InChIKeyIMQYZAVOWUIYQQ-UHFFFAOYSA-N
XLogP0.76
TPSA100.79 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.43
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'dyes5A(27)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-[7-(piperidine-1-carbonyl)-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl]-1,2-dihydropyridine-2-carboxamide?
The IUPAC name of 5-[7-(piperidine-1-carbonyl)-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl]-1,2-dihydropyridine-2-carboxamide (CID 166886679) is 5-[7-(piperidine-1-carbonyl)-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl]-1,2-dihydropyridine-2-carboxamide.
What is the SMILES notation for 5-[7-(piperidine-1-carbonyl)-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl]-1,2-dihydropyridine-2-carboxamide?
The canonical SMILES for 5-[7-(piperidine-1-carbonyl)-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl]-1,2-dihydropyridine-2-carboxamide is NC(=O)C1C=CC(N2CCOc3cc(C(=O)N4CCCCC4)cnc32)=CN1.
What is the InChIKey of 5-[7-(piperidine-1-carbonyl)-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl]-1,2-dihydropyridine-2-carboxamide?
The InChIKey is IMQYZAVOWUIYQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O3/c20-17(25)15-5-4-14(12-21-15)24-8-9-27-16-10-13(11-22-18(16)24)19(26)23-6-2-1-3-7-23/h4-5,10-12,15,21H,1-3,6-9H2,(H2,20,25).
What are the key properties of 5-[7-(piperidine-1-carbonyl)-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl]-1,2-dihydropyridine-2-carboxamide?
5-[7-(piperidine-1-carbonyl)-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl]-1,2-dihydropyridine-2-carboxamide has a molecular weight of 369.43 g/mol, XLogP of 0.76, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[7-(piperidine-1-carbonyl)-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl]-1,2-dihydropyridine-2-carboxamide is sourced from PubChem (CID 166886679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).