[8-amino-6-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-2,7-naphthyridin-3-yl]carbamic acid

C17H16N6O3 — CID 135345113

IUPAC[8-amino-6-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-2,7-naphthyridin-3-yl]carbamic acid
SMILESCc1c(-c2cc3cc(NC(=O)O)ncc3c(N)n2)cnc2c1NCCO2
InChIInChI=1S/C17H16N6O3/c1-8-10(6-21-16-14(8)19-2-3-26-16)12-4-9-5-13(23-17(24)25)20-7-11(9)15(18)22-12/h4-7,19H,2-3H2,1H3,(H2,18,22)(H,20,23)(H,24,25)
InChIKeyCNZOZBHMXVBSGX-UHFFFAOYSA-N
MW352.35 g/mol
LogP2.48
Rot. Bonds2

About [8-amino-6-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-2,7-naphthyridin-3-yl]carbamic acid

[8-amino-6-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-2,7-naphthyridin-3-yl]carbamic acid (PubChem CID 135345113) has the molecular formula C17H16N6O3 and a molecular weight of 352.35 g/mol. Its IUPAC name is [8-amino-6-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-2,7-naphthyridin-3-yl]carbamic acid.

Molecular Properties

Compound Name[8-amino-6-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-2,7-naphthyridin-3-yl]carbamic acid
PubChem CID135345113
Molecular FormulaC17H16N6O3
Molecular Weight352.35 g/mol
Exact Mass352.13
IUPAC Name[8-amino-6-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-2,7-naphthyridin-3-yl]carbamic acid
SMILESCc1c(-c2cc3cc(NC(=O)O)ncc3c(N)n2)cnc2c1NCCO2
InChIInChI=1S/C17H16N6O3/c1-8-10(6-21-16-14(8)19-2-3-26-16)12-4-9-5-13(23-17(24)25)20-7-11(9)15(18)22-12/h4-7,19H,2-3H2,1H3,(H2,18,22)(H,20,23)(H,24,25)
InChIKeyCNZOZBHMXVBSGX-UHFFFAOYSA-N
XLogP2.48
TPSA135.28 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.35
LogP ≤ 52.48
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

Analyze [8-amino-6-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-2,7-naphthyridin-3-yl]carbamic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [8-amino-6-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-2,7-naphthyridin-3-yl]carbamic acid?
The IUPAC name of [8-amino-6-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-2,7-naphthyridin-3-yl]carbamic acid (CID 135345113) is [8-amino-6-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-2,7-naphthyridin-3-yl]carbamic acid.
What is the SMILES notation for [8-amino-6-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-2,7-naphthyridin-3-yl]carbamic acid?
The canonical SMILES for [8-amino-6-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-2,7-naphthyridin-3-yl]carbamic acid is Cc1c(-c2cc3cc(NC(=O)O)ncc3c(N)n2)cnc2c1NCCO2.
What is the InChIKey of [8-amino-6-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-2,7-naphthyridin-3-yl]carbamic acid?
The InChIKey is CNZOZBHMXVBSGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N6O3/c1-8-10(6-21-16-14(8)19-2-3-26-16)12-4-9-5-13(23-17(24)25)20-7-11(9)15(18)22-12/h4-7,19H,2-3H2,1H3,(H2,18,22)(H,20,23)(H,24,25).
What are the key properties of [8-amino-6-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-2,7-naphthyridin-3-yl]carbamic acid?
[8-amino-6-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-2,7-naphthyridin-3-yl]carbamic acid has a molecular weight of 352.35 g/mol, XLogP of 2.48, 2 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [8-amino-6-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-2,7-naphthyridin-3-yl]carbamic acid is sourced from PubChem (CID 135345113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).