N,N-dimethylcyclohexanamine;6-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)quinazolin-4-amine

C24H32N6O — CID 145056040

IUPACN,N-dimethylcyclohexanamine;6-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)quinazolin-4-amine
SMILESCN(C)C1CCCCC1.CN1CCOc2cc(-c3ccc4ncnc(N)c4c3)cnc21
InChIInChI=1S/C16H15N5O.C8H17N/c1-21-4-5-22-14-7-11(8-18-16(14)21)10-2-3-13-12(6-10)15(17)20-9-19-13;1-9(2)8-6-4-3-5-7-8/h2-3,6-9H,4-5H2,1H3,(H2,17,19,20);8H,3-7H2,1-2H3
InChIKeyXGFMYYXXTPQTOU-UHFFFAOYSA-N
MW420.56 g/mol
LogP3.98
Rot. Bonds2

About N,N-dimethylcyclohexanamine;6-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)quinazolin-4-amine

N,N-dimethylcyclohexanamine;6-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)quinazolin-4-amine (PubChem CID 145056040) has the molecular formula C24H32N6O and a molecular weight of 420.56 g/mol. Its IUPAC name is N,N-dimethylcyclohexanamine;6-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)quinazolin-4-amine.

Molecular Properties

Compound NameN,N-dimethylcyclohexanamine;6-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)quinazolin-4-amine
PubChem CID145056040
Molecular FormulaC24H32N6O
Molecular Weight420.56 g/mol
Exact Mass420.26
IUPAC NameN,N-dimethylcyclohexanamine;6-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)quinazolin-4-amine
SMILESCN(C)C1CCCCC1.CN1CCOc2cc(-c3ccc4ncnc(N)c4c3)cnc21
InChIInChI=1S/C16H15N5O.C8H17N/c1-21-4-5-22-14-7-11(8-18-16(14)21)10-2-3-13-12(6-10)15(17)20-9-19-13;1-9(2)8-6-4-3-5-7-8/h2-3,6-9H,4-5H2,1H3,(H2,17,19,20);8H,3-7H2,1-2H3
InChIKeyXGFMYYXXTPQTOU-UHFFFAOYSA-N
XLogP3.98
TPSA80.40 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.56
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethylcyclohexanamine;6-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)quinazolin-4-amine?
The IUPAC name of N,N-dimethylcyclohexanamine;6-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)quinazolin-4-amine (CID 145056040) is N,N-dimethylcyclohexanamine;6-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)quinazolin-4-amine.
What is the SMILES notation for N,N-dimethylcyclohexanamine;6-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)quinazolin-4-amine?
The canonical SMILES for N,N-dimethylcyclohexanamine;6-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)quinazolin-4-amine is CN(C)C1CCCCC1.CN1CCOc2cc(-c3ccc4ncnc(N)c4c3)cnc21.
What is the InChIKey of N,N-dimethylcyclohexanamine;6-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)quinazolin-4-amine?
The InChIKey is XGFMYYXXTPQTOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5O.C8H17N/c1-21-4-5-22-14-7-11(8-18-16(14)21)10-2-3-13-12(6-10)15(17)20-9-19-13;1-9(2)8-6-4-3-5-7-8/h2-3,6-9H,4-5H2,1H3,(H2,17,19,20);8H,3-7H2,1-2H3.
What are the key properties of N,N-dimethylcyclohexanamine;6-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)quinazolin-4-amine?
N,N-dimethylcyclohexanamine;6-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)quinazolin-4-amine has a molecular weight of 420.56 g/mol, XLogP of 3.98, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylcyclohexanamine;6-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)quinazolin-4-amine is sourced from PubChem (CID 145056040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).