1-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-6-yl)pyrrolidine-2-carboxamide

C13H18N4O2 — CID 175747844

IUPAC1-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-6-yl)pyrrolidine-2-carboxamide
SMILESCN1CCOc2ccc(N3CCCC3C(N)=O)nc21
InChIInChI=1S/C13H18N4O2/c1-16-7-8-19-10-4-5-11(15-13(10)16)17-6-2-3-9(17)12(14)18/h4-5,9H,2-3,6-8H2,1H3,(H2,14,18)
InChIKeyWRILOXMVBAVANN-UHFFFAOYSA-N
MW262.31 g/mol
LogP0.36
Rot. Bonds2

About 1-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-6-yl)pyrrolidine-2-carboxamide

1-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-6-yl)pyrrolidine-2-carboxamide (PubChem CID 175747844) has the molecular formula C13H18N4O2 and a molecular weight of 262.31 g/mol. Its IUPAC name is 1-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-6-yl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-6-yl)pyrrolidine-2-carboxamide
PubChem CID175747844
Molecular FormulaC13H18N4O2
Molecular Weight262.31 g/mol
Exact Mass262.14
IUPAC Name1-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-6-yl)pyrrolidine-2-carboxamide
SMILESCN1CCOc2ccc(N3CCCC3C(N)=O)nc21
InChIInChI=1S/C13H18N4O2/c1-16-7-8-19-10-4-5-11(15-13(10)16)17-6-2-3-9(17)12(14)18/h4-5,9H,2-3,6-8H2,1H3,(H2,14,18)
InChIKeyWRILOXMVBAVANN-UHFFFAOYSA-N
XLogP0.36
TPSA71.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-6-yl)pyrrolidine-2-carboxamide?
The IUPAC name of 1-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-6-yl)pyrrolidine-2-carboxamide (CID 175747844) is 1-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-6-yl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-6-yl)pyrrolidine-2-carboxamide?
The canonical SMILES for 1-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-6-yl)pyrrolidine-2-carboxamide is CN1CCOc2ccc(N3CCCC3C(N)=O)nc21.
What is the InChIKey of 1-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-6-yl)pyrrolidine-2-carboxamide?
The InChIKey is WRILOXMVBAVANN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O2/c1-16-7-8-19-10-4-5-11(15-13(10)16)17-6-2-3-9(17)12(14)18/h4-5,9H,2-3,6-8H2,1H3,(H2,14,18).
What are the key properties of 1-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-6-yl)pyrrolidine-2-carboxamide?
1-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-6-yl)pyrrolidine-2-carboxamide has a molecular weight of 262.31 g/mol, XLogP of 0.36, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-6-yl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 175747844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).