2-methyl-3,4-dihydro-2H-pyrido[4,3-b][1,4]oxazine;hydrochloride

C8H11ClN2O — CID 146155437

IUPAC2-methyl-3,4-dihydro-2H-pyrido[4,3-b][1,4]oxazine;hydrochloride
SMILESCC1CNc2cnccc2O1.Cl
InChIInChI=1S/C8H10N2O.ClH/c1-6-4-10-7-5-9-3-2-8(7)11-6;/h2-3,5-6,10H,4H2,1H3;1H
InChIKeyFZQABTNFZKEHHU-UHFFFAOYSA-N
MW186.64 g/mol
LogP1.70
Rot. Bonds

About 2-methyl-3,4-dihydro-2H-pyrido[4,3-b][1,4]oxazine;hydrochloride

2-methyl-3,4-dihydro-2H-pyrido[4,3-b][1,4]oxazine;hydrochloride (PubChem CID 146155437) has the molecular formula C8H11ClN2O and a molecular weight of 186.64 g/mol. Its IUPAC name is 2-methyl-3,4-dihydro-2H-pyrido[4,3-b][1,4]oxazine;hydrochloride.

Molecular Properties

Compound Name2-methyl-3,4-dihydro-2H-pyrido[4,3-b][1,4]oxazine;hydrochloride
PubChem CID146155437
Molecular FormulaC8H11ClN2O
Molecular Weight186.64 g/mol
Exact Mass186.06
IUPAC Name2-methyl-3,4-dihydro-2H-pyrido[4,3-b][1,4]oxazine;hydrochloride
SMILESCC1CNc2cnccc2O1.Cl
InChIInChI=1S/C8H10N2O.ClH/c1-6-4-10-7-5-9-3-2-8(7)11-6;/h2-3,5-6,10H,4H2,1H3;1H
InChIKeyFZQABTNFZKEHHU-UHFFFAOYSA-N
XLogP1.70
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.64
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3,4-dihydro-2H-pyrido[4,3-b][1,4]oxazine;hydrochloride?
The IUPAC name of 2-methyl-3,4-dihydro-2H-pyrido[4,3-b][1,4]oxazine;hydrochloride (CID 146155437) is 2-methyl-3,4-dihydro-2H-pyrido[4,3-b][1,4]oxazine;hydrochloride.
What is the SMILES notation for 2-methyl-3,4-dihydro-2H-pyrido[4,3-b][1,4]oxazine;hydrochloride?
The canonical SMILES for 2-methyl-3,4-dihydro-2H-pyrido[4,3-b][1,4]oxazine;hydrochloride is CC1CNc2cnccc2O1.Cl.
What is the InChIKey of 2-methyl-3,4-dihydro-2H-pyrido[4,3-b][1,4]oxazine;hydrochloride?
The InChIKey is FZQABTNFZKEHHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O.ClH/c1-6-4-10-7-5-9-3-2-8(7)11-6;/h2-3,5-6,10H,4H2,1H3;1H.
What are the key properties of 2-methyl-3,4-dihydro-2H-pyrido[4,3-b][1,4]oxazine;hydrochloride?
2-methyl-3,4-dihydro-2H-pyrido[4,3-b][1,4]oxazine;hydrochloride has a molecular weight of 186.64 g/mol, XLogP of 1.70, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3,4-dihydro-2H-pyrido[4,3-b][1,4]oxazine;hydrochloride is sourced from PubChem (CID 146155437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).