6-(4,5-dihydro-1H-imidazol-2-ylamino)-4H-pyrido[3,2-b][1,4]oxazin-3-one

C10H11N5O2 — CID 70246014

IUPAC6-(4,5-dihydro-1H-imidazol-2-ylamino)-4H-pyrido[3,2-b][1,4]oxazin-3-one
SMILESO=C1COc2ccc(NC3=NCCN3)nc2N1
InChIInChI=1S/C10H11N5O2/c16-8-5-17-6-1-2-7(13-9(6)15-8)14-10-11-3-4-12-10/h1-2H,3-5H2,(H3,11,12,13,14,15,16)
InChIKeyDCDAQFOGAQQLEQ-UHFFFAOYSA-N
MW233.23 g/mol
LogP-0.22
Rot. Bonds1

About 6-(4,5-dihydro-1H-imidazol-2-ylamino)-4H-pyrido[3,2-b][1,4]oxazin-3-one

6-(4,5-dihydro-1H-imidazol-2-ylamino)-4H-pyrido[3,2-b][1,4]oxazin-3-one (PubChem CID 70246014) has the molecular formula C10H11N5O2 and a molecular weight of 233.23 g/mol. Its IUPAC name is 6-(4,5-dihydro-1H-imidazol-2-ylamino)-4H-pyrido[3,2-b][1,4]oxazin-3-one.

Molecular Properties

Compound Name6-(4,5-dihydro-1H-imidazol-2-ylamino)-4H-pyrido[3,2-b][1,4]oxazin-3-one
PubChem CID70246014
Molecular FormulaC10H11N5O2
Molecular Weight233.23 g/mol
Exact Mass233.09
IUPAC Name6-(4,5-dihydro-1H-imidazol-2-ylamino)-4H-pyrido[3,2-b][1,4]oxazin-3-one
SMILESO=C1COc2ccc(NC3=NCCN3)nc2N1
InChIInChI=1S/C10H11N5O2/c16-8-5-17-6-1-2-7(13-9(6)15-8)14-10-11-3-4-12-10/h1-2H,3-5H2,(H3,11,12,13,14,15,16)
InChIKeyDCDAQFOGAQQLEQ-UHFFFAOYSA-N
XLogP-0.22
TPSA87.64 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.23
LogP ≤ 5-0.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(4,5-dihydro-1H-imidazol-2-ylamino)-4H-pyrido[3,2-b][1,4]oxazin-3-one?
The IUPAC name of 6-(4,5-dihydro-1H-imidazol-2-ylamino)-4H-pyrido[3,2-b][1,4]oxazin-3-one (CID 70246014) is 6-(4,5-dihydro-1H-imidazol-2-ylamino)-4H-pyrido[3,2-b][1,4]oxazin-3-one.
What is the SMILES notation for 6-(4,5-dihydro-1H-imidazol-2-ylamino)-4H-pyrido[3,2-b][1,4]oxazin-3-one?
The canonical SMILES for 6-(4,5-dihydro-1H-imidazol-2-ylamino)-4H-pyrido[3,2-b][1,4]oxazin-3-one is O=C1COc2ccc(NC3=NCCN3)nc2N1.
What is the InChIKey of 6-(4,5-dihydro-1H-imidazol-2-ylamino)-4H-pyrido[3,2-b][1,4]oxazin-3-one?
The InChIKey is DCDAQFOGAQQLEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5O2/c16-8-5-17-6-1-2-7(13-9(6)15-8)14-10-11-3-4-12-10/h1-2H,3-5H2,(H3,11,12,13,14,15,16).
What are the key properties of 6-(4,5-dihydro-1H-imidazol-2-ylamino)-4H-pyrido[3,2-b][1,4]oxazin-3-one?
6-(4,5-dihydro-1H-imidazol-2-ylamino)-4H-pyrido[3,2-b][1,4]oxazin-3-one has a molecular weight of 233.23 g/mol, XLogP of -0.22, 1 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4,5-dihydro-1H-imidazol-2-ylamino)-4H-pyrido[3,2-b][1,4]oxazin-3-one is sourced from PubChem (CID 70246014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).