7-methylspiro[2,4-dihydropyrido[3,2-b][1,4]oxazine-3,1'-cyclopropane]

C10H12N2O — CID 139351318

IUPAC7-methylspiro[2,4-dihydropyrido[3,2-b][1,4]oxazine-3,1'-cyclopropane]
SMILESCc1cnc2c(c1)OCC1(CC1)N2
InChIInChI=1S/C10H12N2O/c1-7-4-8-9(11-5-7)12-10(2-3-10)6-13-8/h4-5H,2-3,6H2,1H3,(H,11,12)
InChIKeyAXJZDVGFDNOQCO-UHFFFAOYSA-N
MW176.22 g/mol
LogP1.73
Rot. Bonds

About 7-methylspiro[2,4-dihydropyrido[3,2-b][1,4]oxazine-3,1'-cyclopropane]

7-methylspiro[2,4-dihydropyrido[3,2-b][1,4]oxazine-3,1'-cyclopropane] (PubChem CID 139351318) has the molecular formula C10H12N2O and a molecular weight of 176.22 g/mol. Its IUPAC name is 7-methylspiro[2,4-dihydropyrido[3,2-b][1,4]oxazine-3,1'-cyclopropane].

Molecular Properties

Compound Name7-methylspiro[2,4-dihydropyrido[3,2-b][1,4]oxazine-3,1'-cyclopropane]
PubChem CID139351318
Molecular FormulaC10H12N2O
Molecular Weight176.22 g/mol
Exact Mass176.09
IUPAC Name7-methylspiro[2,4-dihydropyrido[3,2-b][1,4]oxazine-3,1'-cyclopropane]
SMILESCc1cnc2c(c1)OCC1(CC1)N2
InChIInChI=1S/C10H12N2O/c1-7-4-8-9(11-5-7)12-10(2-3-10)6-13-8/h4-5H,2-3,6H2,1H3,(H,11,12)
InChIKeyAXJZDVGFDNOQCO-UHFFFAOYSA-N
XLogP1.73
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-methylspiro[2,4-dihydropyrido[3,2-b][1,4]oxazine-3,1'-cyclopropane]?
The IUPAC name of 7-methylspiro[2,4-dihydropyrido[3,2-b][1,4]oxazine-3,1'-cyclopropane] (CID 139351318) is 7-methylspiro[2,4-dihydropyrido[3,2-b][1,4]oxazine-3,1'-cyclopropane].
What is the SMILES notation for 7-methylspiro[2,4-dihydropyrido[3,2-b][1,4]oxazine-3,1'-cyclopropane]?
The canonical SMILES for 7-methylspiro[2,4-dihydropyrido[3,2-b][1,4]oxazine-3,1'-cyclopropane] is Cc1cnc2c(c1)OCC1(CC1)N2.
What is the InChIKey of 7-methylspiro[2,4-dihydropyrido[3,2-b][1,4]oxazine-3,1'-cyclopropane]?
The InChIKey is AXJZDVGFDNOQCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O/c1-7-4-8-9(11-5-7)12-10(2-3-10)6-13-8/h4-5H,2-3,6H2,1H3,(H,11,12).
What are the key properties of 7-methylspiro[2,4-dihydropyrido[3,2-b][1,4]oxazine-3,1'-cyclopropane]?
7-methylspiro[2,4-dihydropyrido[3,2-b][1,4]oxazine-3,1'-cyclopropane] has a molecular weight of 176.22 g/mol, XLogP of 1.73, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methylspiro[2,4-dihydropyrido[3,2-b][1,4]oxazine-3,1'-cyclopropane] is sourced from PubChem (CID 139351318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).