N-[4-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)phenyl]acetamide

C17H17N3O3 — CID 75443225

IUPACN-[4-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(C(=O)N2CCOc3nc(C)ccc32)cc1
InChIInChI=1S/C17H17N3O3/c1-11-3-8-15-16(18-11)23-10-9-20(15)17(22)13-4-6-14(7-5-13)19-12(2)21/h3-8H,9-10H2,1-2H3,(H,19,21)
InChIKeyIABHMJJTQJJBSY-UHFFFAOYSA-N
MW311.34 g/mol
LogP2.39
Rot. Bonds2

About N-[4-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)phenyl]acetamide

N-[4-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)phenyl]acetamide (PubChem CID 75443225) has the molecular formula C17H17N3O3 and a molecular weight of 311.34 g/mol. Its IUPAC name is N-[4-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)phenyl]acetamide
PubChem CID75443225
Molecular FormulaC17H17N3O3
Molecular Weight311.34 g/mol
Exact Mass311.13
IUPAC NameN-[4-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(C(=O)N2CCOc3nc(C)ccc32)cc1
InChIInChI=1S/C17H17N3O3/c1-11-3-8-15-16(18-11)23-10-9-20(15)17(22)13-4-6-14(7-5-13)19-12(2)21/h3-8H,9-10H2,1-2H3,(H,19,21)
InChIKeyIABHMJJTQJJBSY-UHFFFAOYSA-N
XLogP2.39
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.34
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)phenyl]acetamide?
The IUPAC name of N-[4-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)phenyl]acetamide (CID 75443225) is N-[4-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)phenyl]acetamide.
What is the SMILES notation for N-[4-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)phenyl]acetamide?
The canonical SMILES for N-[4-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)phenyl]acetamide is CC(=O)Nc1ccc(C(=O)N2CCOc3nc(C)ccc32)cc1.
What is the InChIKey of N-[4-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)phenyl]acetamide?
The InChIKey is IABHMJJTQJJBSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O3/c1-11-3-8-15-16(18-11)23-10-9-20(15)17(22)13-4-6-14(7-5-13)19-12(2)21/h3-8H,9-10H2,1-2H3,(H,19,21).
What are the key properties of N-[4-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)phenyl]acetamide?
N-[4-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)phenyl]acetamide has a molecular weight of 311.34 g/mol, XLogP of 2.39, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carbonyl)phenyl]acetamide is sourced from PubChem (CID 75443225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).