6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide

C7H9N3O2 — CID 170562180

IUPAC6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide
SMILESNC(=O)c1ncn2c1COCC2
InChIInChI=1S/C7H9N3O2/c8-7(11)6-5-3-12-2-1-10(5)4-9-6/h4H,1-3H2,(H2,8,11)
InChIKeyLUIDUNMFUHDUDX-UHFFFAOYSA-N
MW167.17 g/mol
LogP-0.49
Rot. Bonds1

About 6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide

6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide (PubChem CID 170562180) has the molecular formula C7H9N3O2 and a molecular weight of 167.17 g/mol. Its IUPAC name is 6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide.

Molecular Properties

Compound Name6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide
PubChem CID170562180
Molecular FormulaC7H9N3O2
Molecular Weight167.17 g/mol
Exact Mass167.07
IUPAC Name6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide
SMILESNC(=O)c1ncn2c1COCC2
InChIInChI=1S/C7H9N3O2/c8-7(11)6-5-3-12-2-1-10(5)4-9-6/h4H,1-3H2,(H2,8,11)
InChIKeyLUIDUNMFUHDUDX-UHFFFAOYSA-N
XLogP-0.49
TPSA70.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.17
LogP ≤ 5-0.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide?
The IUPAC name of 6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide (CID 170562180) is 6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide.
What is the SMILES notation for 6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide?
The canonical SMILES for 6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide is NC(=O)c1ncn2c1COCC2.
What is the InChIKey of 6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide?
The InChIKey is LUIDUNMFUHDUDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O2/c8-7(11)6-5-3-12-2-1-10(5)4-9-6/h4H,1-3H2,(H2,8,11).
What are the key properties of 6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide?
6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide has a molecular weight of 167.17 g/mol, XLogP of -0.49, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine-1-carboxamide is sourced from PubChem (CID 170562180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).