2,3-dimethylspiro[imidazo[1,2-c][1,3]benzoxazine-5,9'-xanthene]

C24H18N2O2 — CID 140688464

IUPAC2,3-dimethylspiro[imidazo[1,2-c][1,3]benzoxazine-5,9'-xanthene]
SMILESCc1nc2n(c1C)C1(Oc3ccccc3-2)c2ccccc2Oc2ccccc21
InChIInChI=1S/C24H18N2O2/c1-15-16(2)26-23(25-15)17-9-3-6-12-20(17)28-24(26)18-10-4-7-13-21(18)27-22-14-8-5-11-19(22)24/h3-14H,1-2H3
InChIKeyNTLKFMCPMDUUPG-UHFFFAOYSA-N
MW366.42 g/mol
LogP5.41
Rot. Bonds

About 2,3-dimethylspiro[imidazo[1,2-c][1,3]benzoxazine-5,9'-xanthene]

2,3-dimethylspiro[imidazo[1,2-c][1,3]benzoxazine-5,9'-xanthene] (PubChem CID 140688464) has the molecular formula C24H18N2O2 and a molecular weight of 366.42 g/mol. Its IUPAC name is 2,3-dimethylspiro[imidazo[1,2-c][1,3]benzoxazine-5,9'-xanthene].

Molecular Properties

Compound Name2,3-dimethylspiro[imidazo[1,2-c][1,3]benzoxazine-5,9'-xanthene]
PubChem CID140688464
Molecular FormulaC24H18N2O2
Molecular Weight366.42 g/mol
Exact Mass366.14
IUPAC Name2,3-dimethylspiro[imidazo[1,2-c][1,3]benzoxazine-5,9'-xanthene]
SMILESCc1nc2n(c1C)C1(Oc3ccccc3-2)c2ccccc2Oc2ccccc21
InChIInChI=1S/C24H18N2O2/c1-15-16(2)26-23(25-15)17-9-3-6-12-20(17)28-24(26)18-10-4-7-13-21(18)27-22-14-8-5-11-19(22)24/h3-14H,1-2H3
InChIKeyNTLKFMCPMDUUPG-UHFFFAOYSA-N
XLogP5.41
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.42
LogP ≤ 55.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N,N,9-trimethylxanthen-9-amine
CID 68833214
6,6-dimethylnaphtho[2,3-c]chromene
CID 59403858
2,7-dimethylspiro[fluorene-9,9'-xanthene]
CID 58250911
1-(9,9-dimethylfluoren-1-yl)-9,9-dimethylxanthene
CID 177127970
1'-amino-3'-methylspiro[2-benzofuran-3,9'-xanthene]-1-one
CID 139650522
2,2-dimethyloxireno[2,3-c]chromene
CID 140974903
boric acid;spiro[fluorene-9,9'-xanthene]
CID 175979012
9,9-diethylxanthene
CID 22447430
2-(9,9-dimethylxanthen-1-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 163752152
2,4-dimethyl-6-(spiro[fluorene-9,9'-xanthene]-2-ylmethyl)-1,3,5-triazine
CID 170265009
spiro[1,3-benzodioxole-2,12'-benzo[a]xanthene]
CID 71361465
14-oxatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaene
CID 139199451

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethylspiro[imidazo[1,2-c][1,3]benzoxazine-5,9'-xanthene]?
The IUPAC name of 2,3-dimethylspiro[imidazo[1,2-c][1,3]benzoxazine-5,9'-xanthene] (CID 140688464) is 2,3-dimethylspiro[imidazo[1,2-c][1,3]benzoxazine-5,9'-xanthene].
What is the SMILES notation for 2,3-dimethylspiro[imidazo[1,2-c][1,3]benzoxazine-5,9'-xanthene]?
The canonical SMILES for 2,3-dimethylspiro[imidazo[1,2-c][1,3]benzoxazine-5,9'-xanthene] is Cc1nc2n(c1C)C1(Oc3ccccc3-2)c2ccccc2Oc2ccccc21.
What is the InChIKey of 2,3-dimethylspiro[imidazo[1,2-c][1,3]benzoxazine-5,9'-xanthene]?
The InChIKey is NTLKFMCPMDUUPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18N2O2/c1-15-16(2)26-23(25-15)17-9-3-6-12-20(17)28-24(26)18-10-4-7-13-21(18)27-22-14-8-5-11-19(22)24/h3-14H,1-2H3.
What are the key properties of 2,3-dimethylspiro[imidazo[1,2-c][1,3]benzoxazine-5,9'-xanthene]?
2,3-dimethylspiro[imidazo[1,2-c][1,3]benzoxazine-5,9'-xanthene] has a molecular weight of 366.42 g/mol, XLogP of 5.41, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethylspiro[imidazo[1,2-c][1,3]benzoxazine-5,9'-xanthene] is sourced from PubChem (CID 140688464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).