4-[3-[4-(1-hydroxyindol-3-yl)quinazolin-7-yl]oxypropyl]morpholine

C23H24N4O3 — CID 139836432

IUPAC4-[3-[4-(1-hydroxyindol-3-yl)quinazolin-7-yl]oxypropyl]morpholine
SMILESOn1cc(-c2ncnc3cc(OCCCN4CCOCC4)ccc23)c2ccccc21
InChIInChI=1S/C23H24N4O3/c28-27-15-20(18-4-1-2-5-22(18)27)23-19-7-6-17(14-21(19)24-16-25-23)30-11-3-8-26-9-12-29-13-10-26/h1-2,4-7,14-16,28H,3,8-13H2
InChIKeyFYQMOIWAHKSZIL-UHFFFAOYSA-N
MW404.47 g/mol
LogP3.59
Rot. Bonds6

About 4-[3-[4-(1-hydroxyindol-3-yl)quinazolin-7-yl]oxypropyl]morpholine

4-[3-[4-(1-hydroxyindol-3-yl)quinazolin-7-yl]oxypropyl]morpholine (PubChem CID 139836432) has the molecular formula C23H24N4O3 and a molecular weight of 404.47 g/mol. Its IUPAC name is 4-[3-[4-(1-hydroxyindol-3-yl)quinazolin-7-yl]oxypropyl]morpholine.

Molecular Properties

Compound Name4-[3-[4-(1-hydroxyindol-3-yl)quinazolin-7-yl]oxypropyl]morpholine
PubChem CID139836432
Molecular FormulaC23H24N4O3
Molecular Weight404.47 g/mol
Exact Mass404.18
IUPAC Name4-[3-[4-(1-hydroxyindol-3-yl)quinazolin-7-yl]oxypropyl]morpholine
SMILESOn1cc(-c2ncnc3cc(OCCCN4CCOCC4)ccc23)c2ccccc21
InChIInChI=1S/C23H24N4O3/c28-27-15-20(18-4-1-2-5-22(18)27)23-19-7-6-17(14-21(19)24-16-25-23)30-11-3-8-26-9-12-29-13-10-26/h1-2,4-7,14-16,28H,3,8-13H2
InChIKeyFYQMOIWAHKSZIL-UHFFFAOYSA-N
XLogP3.59
TPSA72.64 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.47
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}

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Related Compounds

7-(3-morpholin-4-ylpropoxy)-N-(4-phenylmethoxyphenyl)quinazolin-4-amine
CID 54490718
2-hydroxy-3-[7-(2-morpholin-4-ylethoxy)quinazolin-4-yl]-1H-indole-5-carbonitrile;dihydrochloride
CID 135416047
7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine
CID 22649254
4-(3-benzo[a]phenazin-5-yloxypropyl)morpholine
CID 71722358
4-[2-[4-(1-phenylpyrazol-4-yl)quinolin-7-yl]oxyethyl]morpholine
CID 70683517
1-[4-[3-(4-aminoquinazolin-7-yl)oxypropyl]piperazin-1-yl]ethanone
CID 141289176
4-[3-(2-methyl-4-pyrrolidin-1-ylquinolin-7-yl)oxypropyl]morpholine;hydrochloride
CID 22641400
1-cyclohexyl-3-[4-[[7-(3-morpholin-4-ylpropoxy)quinazolin-4-yl]amino]phenyl]urea
CID 50898764
3-[3-(1,4-oxazepan-4-yl)propoxy]benzoic acid
CID 63075111
7-(3-piperazin-1-ylpropoxy)quinazolin-4-amine
CID 141103822
4-[2-(3-butoxyphenoxy)ethyl]morpholine
CID 2993436
4-[3-(3-iodophenoxy)propyl]morpholine
CID 47520354

Frequently Asked Questions

What is the IUPAC name of 4-[3-[4-(1-hydroxyindol-3-yl)quinazolin-7-yl]oxypropyl]morpholine?
The IUPAC name of 4-[3-[4-(1-hydroxyindol-3-yl)quinazolin-7-yl]oxypropyl]morpholine (CID 139836432) is 4-[3-[4-(1-hydroxyindol-3-yl)quinazolin-7-yl]oxypropyl]morpholine.
What is the SMILES notation for 4-[3-[4-(1-hydroxyindol-3-yl)quinazolin-7-yl]oxypropyl]morpholine?
The canonical SMILES for 4-[3-[4-(1-hydroxyindol-3-yl)quinazolin-7-yl]oxypropyl]morpholine is On1cc(-c2ncnc3cc(OCCCN4CCOCC4)ccc23)c2ccccc21.
What is the InChIKey of 4-[3-[4-(1-hydroxyindol-3-yl)quinazolin-7-yl]oxypropyl]morpholine?
The InChIKey is FYQMOIWAHKSZIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O3/c28-27-15-20(18-4-1-2-5-22(18)27)23-19-7-6-17(14-21(19)24-16-25-23)30-11-3-8-26-9-12-29-13-10-26/h1-2,4-7,14-16,28H,3,8-13H2.
What are the key properties of 4-[3-[4-(1-hydroxyindol-3-yl)quinazolin-7-yl]oxypropyl]morpholine?
4-[3-[4-(1-hydroxyindol-3-yl)quinazolin-7-yl]oxypropyl]morpholine has a molecular weight of 404.47 g/mol, XLogP of 3.59, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[4-(1-hydroxyindol-3-yl)quinazolin-7-yl]oxypropyl]morpholine is sourced from PubChem (CID 139836432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).