6-amino-2-(2-morpholin-4-ylethylamino)-1,7-dihydroimidazo[4,5-g]quinazolin-8-one

C15H19N7O2 — CID 135566918

IUPAC6-amino-2-(2-morpholin-4-ylethylamino)-1,7-dihydroimidazo[4,5-g]quinazolin-8-one
SMILESNc1nc2cc3nc(NCCN4CCOCC4)[nH]c3cc2c(=O)[nH]1
InChIInChI=1S/C15H19N7O2/c16-14-18-10-8-12-11(7-9(10)13(23)21-14)19-15(20-12)17-1-2-22-3-5-24-6-4-22/h7-8H,1-6H2,(H2,17,19,20)(H3,16,18,21,23)
InChIKeyJUHXOBNFTFUPKQ-UHFFFAOYSA-N
MW329.36 g/mol
LogP0.13
Rot. Bonds4

About 6-amino-2-(2-morpholin-4-ylethylamino)-1,7-dihydroimidazo[4,5-g]quinazolin-8-one

6-amino-2-(2-morpholin-4-ylethylamino)-1,7-dihydroimidazo[4,5-g]quinazolin-8-one (PubChem CID 135566918) has the molecular formula C15H19N7O2 and a molecular weight of 329.36 g/mol. Its IUPAC name is 6-amino-2-(2-morpholin-4-ylethylamino)-1,7-dihydroimidazo[4,5-g]quinazolin-8-one.

Molecular Properties

Compound Name6-amino-2-(2-morpholin-4-ylethylamino)-1,7-dihydroimidazo[4,5-g]quinazolin-8-one
PubChem CID135566918
Molecular FormulaC15H19N7O2
Molecular Weight329.36 g/mol
Exact Mass329.16
IUPAC Name6-amino-2-(2-morpholin-4-ylethylamino)-1,7-dihydroimidazo[4,5-g]quinazolin-8-one
SMILESNc1nc2cc3nc(NCCN4CCOCC4)[nH]c3cc2c(=O)[nH]1
InChIInChI=1S/C15H19N7O2/c16-14-18-10-8-12-11(7-9(10)13(23)21-14)19-15(20-12)17-1-2-22-3-5-24-6-4-22/h7-8H,1-6H2,(H2,17,19,20)(H3,16,18,21,23)
InChIKeyJUHXOBNFTFUPKQ-UHFFFAOYSA-N
XLogP0.13
TPSA124.95 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 50.13
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-amino-2-(2-morpholin-4-ylethylamino)-1,7-dihydroimidazo[4,5-g]quinazolin-8-one?
The IUPAC name of 6-amino-2-(2-morpholin-4-ylethylamino)-1,7-dihydroimidazo[4,5-g]quinazolin-8-one (CID 135566918) is 6-amino-2-(2-morpholin-4-ylethylamino)-1,7-dihydroimidazo[4,5-g]quinazolin-8-one.
What is the SMILES notation for 6-amino-2-(2-morpholin-4-ylethylamino)-1,7-dihydroimidazo[4,5-g]quinazolin-8-one?
The canonical SMILES for 6-amino-2-(2-morpholin-4-ylethylamino)-1,7-dihydroimidazo[4,5-g]quinazolin-8-one is Nc1nc2cc3nc(NCCN4CCOCC4)[nH]c3cc2c(=O)[nH]1.
What is the InChIKey of 6-amino-2-(2-morpholin-4-ylethylamino)-1,7-dihydroimidazo[4,5-g]quinazolin-8-one?
The InChIKey is JUHXOBNFTFUPKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N7O2/c16-14-18-10-8-12-11(7-9(10)13(23)21-14)19-15(20-12)17-1-2-22-3-5-24-6-4-22/h7-8H,1-6H2,(H2,17,19,20)(H3,16,18,21,23).
What are the key properties of 6-amino-2-(2-morpholin-4-ylethylamino)-1,7-dihydroimidazo[4,5-g]quinazolin-8-one?
6-amino-2-(2-morpholin-4-ylethylamino)-1,7-dihydroimidazo[4,5-g]quinazolin-8-one has a molecular weight of 329.36 g/mol, XLogP of 0.13, 4 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-2-(2-morpholin-4-ylethylamino)-1,7-dihydroimidazo[4,5-g]quinazolin-8-one is sourced from PubChem (CID 135566918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).