2,3-dihydro-1H-pyrido[3,2-g][1,4]benzoxazine

C11H10N2O — CID 21353728

IUPAC2,3-dihydro-1H-pyrido[3,2-g][1,4]benzoxazine
SMILESc1cnc2cc3c(cc2c1)NCCO3
InChIInChI=1S/C11H10N2O/c1-2-8-6-10-11(14-5-4-13-10)7-9(8)12-3-1/h1-3,6-7,13H,4-5H2
InChIKeyAYBQJEDJYPKKPD-UHFFFAOYSA-N
MW186.21 g/mol
LogP2.04
Rot. Bonds

About 2,3-dihydro-1H-pyrido[3,2-g][1,4]benzoxazine

2,3-dihydro-1H-pyrido[3,2-g][1,4]benzoxazine (PubChem CID 21353728) has the molecular formula C11H10N2O and a molecular weight of 186.21 g/mol. Its IUPAC name is 2,3-dihydro-1H-pyrido[3,2-g][1,4]benzoxazine.

Molecular Properties

Compound Name2,3-dihydro-1H-pyrido[3,2-g][1,4]benzoxazine
PubChem CID21353728
Molecular FormulaC11H10N2O
Molecular Weight186.21 g/mol
Exact Mass186.08
IUPAC Name2,3-dihydro-1H-pyrido[3,2-g][1,4]benzoxazine
SMILESc1cnc2cc3c(cc2c1)NCCO3
InChIInChI=1S/C11H10N2O/c1-2-8-6-10-11(14-5-4-13-10)7-9(8)12-3-1/h1-3,6-7,13H,4-5H2
InChIKeyAYBQJEDJYPKKPD-UHFFFAOYSA-N
XLogP2.04
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-dihydro-2H-benzo[g][1,4]benzoxazine
CID 83789533
3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;dihydrochloride
CID 141075703
6,7-dimethyl-3,4-dihydro-2H-1,4-benzoxazine
CID 20571249
3,4-dihydro-2H-1,4-benzoxazin-7-amine
CID 11480537
2-quinolin-6-yl-4,5-dihydro-1,3-oxazole
CID 174566262
CID 89013099
CID 89013099
7-bromo-3,4-dihydro-2H-1,4-benzoxazine;hydrochloride
CID 56965755
6,7-ditert-butyl-3,4-dihydro-2H-1,4-benzoxazine
CID 162423996
7-tert-butyl-3,4-dihydro-2H-pyrido[4,3-b][1,4]oxazine
CID 155612954
3,4-dihydro-2H-1,4-benzoxazin-7-yloxy(trimethyl)silane
CID 167717191
3,4-dihydro-2H-pyrido[4,3-b][1,4]oxazin-7-ylmethanol
CID 141190538
oxirane;quinoline
CID 157282028

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-pyrido[3,2-g][1,4]benzoxazine?
The IUPAC name of 2,3-dihydro-1H-pyrido[3,2-g][1,4]benzoxazine (CID 21353728) is 2,3-dihydro-1H-pyrido[3,2-g][1,4]benzoxazine.
What is the SMILES notation for 2,3-dihydro-1H-pyrido[3,2-g][1,4]benzoxazine?
The canonical SMILES for 2,3-dihydro-1H-pyrido[3,2-g][1,4]benzoxazine is c1cnc2cc3c(cc2c1)NCCO3.
What is the InChIKey of 2,3-dihydro-1H-pyrido[3,2-g][1,4]benzoxazine?
The InChIKey is AYBQJEDJYPKKPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O/c1-2-8-6-10-11(14-5-4-13-10)7-9(8)12-3-1/h1-3,6-7,13H,4-5H2.
What are the key properties of 2,3-dihydro-1H-pyrido[3,2-g][1,4]benzoxazine?
2,3-dihydro-1H-pyrido[3,2-g][1,4]benzoxazine has a molecular weight of 186.21 g/mol, XLogP of 2.04, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-pyrido[3,2-g][1,4]benzoxazine is sourced from PubChem (CID 21353728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).