(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-[(3S)-3-methylmorpholin-4-yl]methanone

C17H19N5O3 — CID 138689546

IUPAC(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-[(3S)-3-methylmorpholin-4-yl]methanone
SMILESCOc1cccc2c1nc(N)n1cc(C(=O)N3CCOC[C@@H]3C)nc21
InChIInChI=1S/C17H19N5O3/c1-10-9-25-7-6-21(10)16(23)12-8-22-15(19-12)11-4-3-5-13(24-2)14(11)20-17(22)18/h3-5,8,10H,6-7,9H2,1-2H3,(H2,18,20)/t10-/m0/s1
InChIKeyCDVZTRDGEZUAGJ-JTQLQIEISA-N
MW341.37 g/mol
LogP1.33
Rot. Bonds2

About (5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-[(3S)-3-methylmorpholin-4-yl]methanone

(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-[(3S)-3-methylmorpholin-4-yl]methanone (PubChem CID 138689546) has the molecular formula C17H19N5O3 and a molecular weight of 341.37 g/mol. Its IUPAC name is (5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-[(3S)-3-methylmorpholin-4-yl]methanone.

Molecular Properties

Compound Name(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-[(3S)-3-methylmorpholin-4-yl]methanone
PubChem CID138689546
Molecular FormulaC17H19N5O3
Molecular Weight341.37 g/mol
Exact Mass341.15
IUPAC Name(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-[(3S)-3-methylmorpholin-4-yl]methanone
SMILESCOc1cccc2c1nc(N)n1cc(C(=O)N3CCOC[C@@H]3C)nc21
InChIInChI=1S/C17H19N5O3/c1-10-9-25-7-6-21(10)16(23)12-8-22-15(19-12)11-4-3-5-13(24-2)14(11)20-17(22)18/h3-5,8,10H,6-7,9H2,1-2H3,(H2,18,20)/t10-/m0/s1
InChIKeyCDVZTRDGEZUAGJ-JTQLQIEISA-N
XLogP1.33
TPSA94.98 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of (5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-[(3S)-3-methylmorpholin-4-yl]methanone?
The IUPAC name of (5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-[(3S)-3-methylmorpholin-4-yl]methanone (CID 138689546) is (5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-[(3S)-3-methylmorpholin-4-yl]methanone.
What is the SMILES notation for (5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-[(3S)-3-methylmorpholin-4-yl]methanone?
The canonical SMILES for (5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-[(3S)-3-methylmorpholin-4-yl]methanone is COc1cccc2c1nc(N)n1cc(C(=O)N3CCOC[C@@H]3C)nc21.
What is the InChIKey of (5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-[(3S)-3-methylmorpholin-4-yl]methanone?
The InChIKey is CDVZTRDGEZUAGJ-JTQLQIEISA-N. The full InChI is InChI=1S/C17H19N5O3/c1-10-9-25-7-6-21(10)16(23)12-8-22-15(19-12)11-4-3-5-13(24-2)14(11)20-17(22)18/h3-5,8,10H,6-7,9H2,1-2H3,(H2,18,20)/t10-/m0/s1.
What are the key properties of (5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-[(3S)-3-methylmorpholin-4-yl]methanone?
(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-[(3S)-3-methylmorpholin-4-yl]methanone has a molecular weight of 341.37 g/mol, XLogP of 1.33, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-[(3S)-3-methylmorpholin-4-yl]methanone is sourced from PubChem (CID 138689546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).