7-(3-methoxyphenyl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine

C14H14N2O2 — CID 117000684

IUPAC7-(3-methoxyphenyl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine
SMILESCOc1cccc(-c2cnc3c(c2)OCCN3)c1
InChIInChI=1S/C14H14N2O2/c1-17-12-4-2-3-10(7-12)11-8-13-14(16-9-11)15-5-6-18-13/h2-4,7-9H,5-6H2,1H3,(H,15,16)
InChIKeySHPWFJNONMZRQW-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.56
Rot. Bonds2

About 7-(3-methoxyphenyl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine

7-(3-methoxyphenyl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine (PubChem CID 117000684) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 7-(3-methoxyphenyl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine.

Molecular Properties

Compound Name7-(3-methoxyphenyl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine
PubChem CID117000684
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name7-(3-methoxyphenyl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine
SMILESCOc1cccc(-c2cnc3c(c2)OCCN3)c1
InChIInChI=1S/C14H14N2O2/c1-17-12-4-2-3-10(7-12)11-8-13-14(16-9-11)15-5-6-18-13/h2-4,7-9H,5-6H2,1H3,(H,15,16)
InChIKeySHPWFJNONMZRQW-UHFFFAOYSA-N
XLogP2.56
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-(3-methoxyphenyl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine?
The IUPAC name of 7-(3-methoxyphenyl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine (CID 117000684) is 7-(3-methoxyphenyl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine.
What is the SMILES notation for 7-(3-methoxyphenyl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine?
The canonical SMILES for 7-(3-methoxyphenyl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine is COc1cccc(-c2cnc3c(c2)OCCN3)c1.
What is the InChIKey of 7-(3-methoxyphenyl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine?
The InChIKey is SHPWFJNONMZRQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-17-12-4-2-3-10(7-12)11-8-13-14(16-9-11)15-5-6-18-13/h2-4,7-9H,5-6H2,1H3,(H,15,16).
What are the key properties of 7-(3-methoxyphenyl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine?
7-(3-methoxyphenyl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine has a molecular weight of 242.28 g/mol, XLogP of 2.56, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3-methoxyphenyl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine is sourced from PubChem (CID 117000684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).