morpholin-4-yl-[8-(morpholin-2-ylmethoxy)-2H-chromen-3-yl]methanone

C19H24N2O5 — CID 11792868

IUPACmorpholin-4-yl-[8-(morpholin-2-ylmethoxy)-2H-chromen-3-yl]methanone
SMILESO=C(C1=Cc2cccc(OCC3CNCCO3)c2OC1)N1CCOCC1
InChIInChI=1S/C19H24N2O5/c22-19(21-5-8-23-9-6-21)15-10-14-2-1-3-17(18(14)26-12-15)25-13-16-11-20-4-7-24-16/h1-3,10,16,20H,4-9,11-13H2
InChIKeyIVMOCEWMFHUWLQ-UHFFFAOYSA-N
MW360.41 g/mol
LogP0.69
Rot. Bonds4

About morpholin-4-yl-[8-(morpholin-2-ylmethoxy)-2H-chromen-3-yl]methanone

morpholin-4-yl-[8-(morpholin-2-ylmethoxy)-2H-chromen-3-yl]methanone (PubChem CID 11792868) has the molecular formula C19H24N2O5 and a molecular weight of 360.41 g/mol. Its IUPAC name is morpholin-4-yl-[8-(morpholin-2-ylmethoxy)-2H-chromen-3-yl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[8-(morpholin-2-ylmethoxy)-2H-chromen-3-yl]methanone
PubChem CID11792868
Molecular FormulaC19H24N2O5
Molecular Weight360.41 g/mol
Exact Mass360.17
IUPAC Namemorpholin-4-yl-[8-(morpholin-2-ylmethoxy)-2H-chromen-3-yl]methanone
SMILESO=C(C1=Cc2cccc(OCC3CNCCO3)c2OC1)N1CCOCC1
InChIInChI=1S/C19H24N2O5/c22-19(21-5-8-23-9-6-21)15-10-14-2-1-3-17(18(14)26-12-15)25-13-16-11-20-4-7-24-16/h1-3,10,16,20H,4-9,11-13H2
InChIKeyIVMOCEWMFHUWLQ-UHFFFAOYSA-N
XLogP0.69
TPSA69.26 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

Nas-181
CID 9955014
(2E)-3-(3,4-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)prop-2-enamide
CID 763648
8-Ethoxy-3-(morpholin-4-ylcarbonyl)chromen-2-one
CID 1247427
8-methoxy-2-oxo-N-prop-2-enylchromene-3-carboxamide
CID 2146230
[2-(2,6-Dimethylmorpholin-4-yl)-2-oxoethyl] 8-methoxy-2-oxochromene-3-carboxylate
CID 4248118
(E)-3-(2,3-dimethoxyphenyl)-1-(2,6-dimethylmorpholin-4-yl)prop-2-en-1-one
CID 6211927
3-[(2,6-dimethyl-4-morpholinyl)carbonyl]-8-ethoxy-2H-chromen-2-one
CID 6471808
N-[2-(1-benzylpiperidin-4-yl)ethyl]-8-methoxy-2-oxochromene-3-carboxamide
CID 76331720
8-butoxy-2-oxo-N-propan-2-ylchromene-3-carboxamide
CID 72715372
8-butoxy-N-cyclohexyl-2-oxochromene-3-carboxamide
CID 72715615
N-cyclohexyl-2-oxo-8-pentoxychromene-3-carboxamide
CID 72715697
(E)-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(4-propan-2-yloxyphenyl)prop-2-enamide
CID 6077199

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[8-(morpholin-2-ylmethoxy)-2H-chromen-3-yl]methanone?
The IUPAC name of morpholin-4-yl-[8-(morpholin-2-ylmethoxy)-2H-chromen-3-yl]methanone (CID 11792868) is morpholin-4-yl-[8-(morpholin-2-ylmethoxy)-2H-chromen-3-yl]methanone.
What is the SMILES notation for morpholin-4-yl-[8-(morpholin-2-ylmethoxy)-2H-chromen-3-yl]methanone?
The canonical SMILES for morpholin-4-yl-[8-(morpholin-2-ylmethoxy)-2H-chromen-3-yl]methanone is O=C(C1=Cc2cccc(OCC3CNCCO3)c2OC1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-[8-(morpholin-2-ylmethoxy)-2H-chromen-3-yl]methanone?
The InChIKey is IVMOCEWMFHUWLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O5/c22-19(21-5-8-23-9-6-21)15-10-14-2-1-3-17(18(14)26-12-15)25-13-16-11-20-4-7-24-16/h1-3,10,16,20H,4-9,11-13H2.
What are the key properties of morpholin-4-yl-[8-(morpholin-2-ylmethoxy)-2H-chromen-3-yl]methanone?
morpholin-4-yl-[8-(morpholin-2-ylmethoxy)-2H-chromen-3-yl]methanone has a molecular weight of 360.41 g/mol, XLogP of 0.69, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[8-(morpholin-2-ylmethoxy)-2H-chromen-3-yl]methanone is sourced from PubChem (CID 11792868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).