N-[(5-methylfuran-2-yl)methyl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide

C14H13N3O4 — CID 146579473

IUPACN-[(5-methylfuran-2-yl)methyl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide
SMILESCc1ccc(CNC(=O)c2ccc3c(n2)NC(=O)CO3)o1
InChIInChI=1S/C14H13N3O4/c1-8-2-3-9(21-8)6-15-14(19)10-4-5-11-13(16-10)17-12(18)7-20-11/h2-5H,6-7H2,1H3,(H,15,19)(H,16,17,18)
InChIKeyKVUSWUDEWDTSKV-UHFFFAOYSA-N
MW287.28 g/mol
LogP1.24
Rot. Bonds3

About N-[(5-methylfuran-2-yl)methyl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide

N-[(5-methylfuran-2-yl)methyl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide (PubChem CID 146579473) has the molecular formula C14H13N3O4 and a molecular weight of 287.28 g/mol. Its IUPAC name is N-[(5-methylfuran-2-yl)methyl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide.

Molecular Properties

Compound NameN-[(5-methylfuran-2-yl)methyl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide
PubChem CID146579473
Molecular FormulaC14H13N3O4
Molecular Weight287.28 g/mol
Exact Mass287.09
IUPAC NameN-[(5-methylfuran-2-yl)methyl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide
SMILESCc1ccc(CNC(=O)c2ccc3c(n2)NC(=O)CO3)o1
InChIInChI=1S/C14H13N3O4/c1-8-2-3-9(21-8)6-15-14(19)10-4-5-11-13(16-10)17-12(18)7-20-11/h2-5H,6-7H2,1H3,(H,15,19)(H,16,17,18)
InChIKeyKVUSWUDEWDTSKV-UHFFFAOYSA-N
XLogP1.24
TPSA93.46 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.28
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[(5-methylfuran-2-yl)methyl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide with MolForge

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Related Compounds

N,3-dioxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide
CID 143404652
6-[(5-methylfuran-2-yl)methylamino]-4H-1,4-benzoxazin-3-one
CID 28651607
6-cyano-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide
CID 115116521
6-[(1S)-1-[(5-methylfuran-2-yl)methylamino]ethyl]-4H-1,4-benzoxazin-3-one
CID 34541568
6-[1-[(5-methylfuran-2-yl)methylamino]ethyl]-4H-1,4-benzoxazin-3-one
CID 51078445
6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridazine-3-carboxamide
CID 62524620
2-fluoro-N-[(3-oxo-4H-pyrido[3,2-b][1,4]oxazin-6-yl)methyl]acetamide
CID 141263802
N-methyl-3-oxo-N-piperidin-4-yl-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide
CID 71215153
5-(1,3-benzodioxol-5-yl)-N-[(5-methylfuran-2-yl)methyl]-1,2-oxazole-3-carboxamide
CID 46087404
4-chloro-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide
CID 55081452
2-(aminomethyl)-N-[(5-methylfuran-2-yl)methyl]-1,3-thiazole-4-carboxamide
CID 66376144
N-[(5-methylfuran-2-yl)methyl]-5-(5-methylthiophen-2-yl)-1H-pyrazole-3-carboxamide
CID 70750896

Frequently Asked Questions

What is the IUPAC name of N-[(5-methylfuran-2-yl)methyl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide?
The IUPAC name of N-[(5-methylfuran-2-yl)methyl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide (CID 146579473) is N-[(5-methylfuran-2-yl)methyl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide.
What is the SMILES notation for N-[(5-methylfuran-2-yl)methyl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide?
The canonical SMILES for N-[(5-methylfuran-2-yl)methyl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide is Cc1ccc(CNC(=O)c2ccc3c(n2)NC(=O)CO3)o1.
What is the InChIKey of N-[(5-methylfuran-2-yl)methyl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide?
The InChIKey is KVUSWUDEWDTSKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O4/c1-8-2-3-9(21-8)6-15-14(19)10-4-5-11-13(16-10)17-12(18)7-20-11/h2-5H,6-7H2,1H3,(H,15,19)(H,16,17,18).
What are the key properties of N-[(5-methylfuran-2-yl)methyl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide?
N-[(5-methylfuran-2-yl)methyl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide has a molecular weight of 287.28 g/mol, XLogP of 1.24, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methylfuran-2-yl)methyl]-3-oxo-4H-pyrido[3,2-b][1,4]oxazine-6-carboxamide is sourced from PubChem (CID 146579473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).