N-methoxy-N-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide

C9H13N3O3 — CID 71789390

IUPACN-methoxy-N-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide
SMILESCON(C)C(=O)c1cc2n(n1)CCCO2
InChIInChI=1S/C9H13N3O3/c1-11(14-2)9(13)7-6-8-12(10-7)4-3-5-15-8/h6H,3-5H2,1-2H3
InChIKeyKWBBODHYXUSGAV-UHFFFAOYSA-N
MW211.22 g/mol
LogP0.30
Rot. Bonds2

About N-methoxy-N-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide

N-methoxy-N-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide (PubChem CID 71789390) has the molecular formula C9H13N3O3 and a molecular weight of 211.22 g/mol. Its IUPAC name is N-methoxy-N-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide.

Molecular Properties

Compound NameN-methoxy-N-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide
PubChem CID71789390
Molecular FormulaC9H13N3O3
Molecular Weight211.22 g/mol
Exact Mass211.10
IUPAC NameN-methoxy-N-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide
SMILESCON(C)C(=O)c1cc2n(n1)CCCO2
InChIInChI=1S/C9H13N3O3/c1-11(14-2)9(13)7-6-8-12(10-7)4-3-5-15-8/h6H,3-5H2,1-2H3
InChIKeyKWBBODHYXUSGAV-UHFFFAOYSA-N
XLogP0.30
TPSA56.59 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.22
LogP ≤ 50.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

CID 11845247
CID 11845247
CID 11847129
CID 11847129
CID 71789296
CID 71789296
CID 71789299
CID 71789299
CID 71789301
CID 71789301
CID 71789395
CID 71789395
CID 97106797
CID 97106797
CID 71789350
CID 71789350
CID 71777853
CID 71777853
CID 165652574
CID 165652574
CID 165664170
CID 165664170
CID 71789274
CID 71789274

Frequently Asked Questions

What is the IUPAC name of N-methoxy-N-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide?
The IUPAC name of N-methoxy-N-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide (CID 71789390) is N-methoxy-N-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide.
What is the SMILES notation for N-methoxy-N-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide?
The canonical SMILES for N-methoxy-N-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide is CON(C)C(=O)c1cc2n(n1)CCCO2.
What is the InChIKey of N-methoxy-N-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide?
The InChIKey is KWBBODHYXUSGAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O3/c1-11(14-2)9(13)7-6-8-12(10-7)4-3-5-15-8/h6H,3-5H2,1-2H3.
What are the key properties of N-methoxy-N-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide?
N-methoxy-N-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide has a molecular weight of 211.22 g/mol, XLogP of 0.30, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide is sourced from PubChem (CID 71789390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).