(2-ethoxy-6-methyl-3-pyridinyl)-[(2S)-2-(5-methylfuran-2-yl)morpholin-4-yl]methanone

C18H22N2O4 — CID 100705820

IUPAC(2-ethoxy-6-methyl-3-pyridinyl)-[(2S)-2-(5-methylfuran-2-yl)morpholin-4-yl]methanone
SMILESCCOc1nc(C)ccc1C(=O)N1CCO[C@H](c2ccc(C)o2)C1
InChIInChI=1S/C18H22N2O4/c1-4-22-17-14(7-5-12(2)19-17)18(21)20-9-10-23-16(11-20)15-8-6-13(3)24-15/h5-8,16H,4,9-11H2,1-3H3/t16-/m0/s1
InChIKeyAUFGPONNGXEZHC-INIZCTEOSA-N
MW330.38 g/mol
LogP2.90
Rot. Bonds4

About (2-ethoxy-6-methyl-3-pyridinyl)-[(2S)-2-(5-methylfuran-2-yl)morpholin-4-yl]methanone

(2-ethoxy-6-methyl-3-pyridinyl)-[(2S)-2-(5-methylfuran-2-yl)morpholin-4-yl]methanone (PubChem CID 100705820) has the molecular formula C18H22N2O4 and a molecular weight of 330.38 g/mol. Its IUPAC name is (2-ethoxy-6-methyl-3-pyridinyl)-[(2S)-2-(5-methylfuran-2-yl)morpholin-4-yl]methanone.

Molecular Properties

Compound Name(2-ethoxy-6-methyl-3-pyridinyl)-[(2S)-2-(5-methylfuran-2-yl)morpholin-4-yl]methanone
PubChem CID100705820
Molecular FormulaC18H22N2O4
Molecular Weight330.38 g/mol
Exact Mass330.16
IUPAC Name(2-ethoxy-6-methyl-3-pyridinyl)-[(2S)-2-(5-methylfuran-2-yl)morpholin-4-yl]methanone
SMILESCCOc1nc(C)ccc1C(=O)N1CCO[C@H](c2ccc(C)o2)C1
InChIInChI=1S/C18H22N2O4/c1-4-22-17-14(7-5-12(2)19-17)18(21)20-9-10-23-16(11-20)15-8-6-13(3)24-15/h5-8,16H,4,9-11H2,1-3H3/t16-/m0/s1
InChIKeyAUFGPONNGXEZHC-INIZCTEOSA-N
XLogP2.90
TPSA64.80 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.38
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(dimethylamino)-6-methyl-3-pyridinyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide
CID 75389140
[2-(3-aminopyrazin-2-yl)morpholin-4-yl]-(2-ethoxy-3-pyridinyl)methanone
CID 110112819
[2-(4-methoxyphenyl)quinolin-4-yl]-[(2R)-2-(5-methylfuran-2-yl)morpholin-4-yl]methanone
CID 97071310
(2R)-N-(2-methoxy-3-pyridinyl)-2-(5-methylfuran-2-yl)morpholine-4-carboxamide
CID 124603422
4-(2-ethoxypyridine-3-carbonyl)morpholine-2-carboxylic acid
CID 119239609
[2-[2-(dimethylamino)pyrimidin-4-yl]morpholin-4-yl]-(3-ethyl-1-methylpyrazol-4-yl)methanone
CID 128974121
(2S)-N-[(1R,2R)-2-methoxycyclohexyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide
CID 98874217
(2-ethoxy-3-pyridinyl)-[(3S)-3-(4-methylpyrimidin-2-yl)pyrrolidin-1-yl]methanone
CID 124949318
N-[2-(2-hydroxyethyl)-4-methylpentyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide
CID 109398792
(2-ethoxy-6-methyl-3-pyridinyl)-[4-(1H-indol-3-yl)piperidin-1-yl]methanone
CID 119047088
(4-ethoxyphenyl)-[2-(4-methylphenyl)morpholin-4-yl]methanone
CID 121134773
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide
CID 75432430

Frequently Asked Questions

What is the IUPAC name of (2-ethoxy-6-methyl-3-pyridinyl)-[(2S)-2-(5-methylfuran-2-yl)morpholin-4-yl]methanone?
The IUPAC name of (2-ethoxy-6-methyl-3-pyridinyl)-[(2S)-2-(5-methylfuran-2-yl)morpholin-4-yl]methanone (CID 100705820) is (2-ethoxy-6-methyl-3-pyridinyl)-[(2S)-2-(5-methylfuran-2-yl)morpholin-4-yl]methanone.
What is the SMILES notation for (2-ethoxy-6-methyl-3-pyridinyl)-[(2S)-2-(5-methylfuran-2-yl)morpholin-4-yl]methanone?
The canonical SMILES for (2-ethoxy-6-methyl-3-pyridinyl)-[(2S)-2-(5-methylfuran-2-yl)morpholin-4-yl]methanone is CCOc1nc(C)ccc1C(=O)N1CCO[C@H](c2ccc(C)o2)C1.
What is the InChIKey of (2-ethoxy-6-methyl-3-pyridinyl)-[(2S)-2-(5-methylfuran-2-yl)morpholin-4-yl]methanone?
The InChIKey is AUFGPONNGXEZHC-INIZCTEOSA-N. The full InChI is InChI=1S/C18H22N2O4/c1-4-22-17-14(7-5-12(2)19-17)18(21)20-9-10-23-16(11-20)15-8-6-13(3)24-15/h5-8,16H,4,9-11H2,1-3H3/t16-/m0/s1.
What are the key properties of (2-ethoxy-6-methyl-3-pyridinyl)-[(2S)-2-(5-methylfuran-2-yl)morpholin-4-yl]methanone?
(2-ethoxy-6-methyl-3-pyridinyl)-[(2S)-2-(5-methylfuran-2-yl)morpholin-4-yl]methanone has a molecular weight of 330.38 g/mol, XLogP of 2.90, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethoxy-6-methyl-3-pyridinyl)-[(2S)-2-(5-methylfuran-2-yl)morpholin-4-yl]methanone is sourced from PubChem (CID 100705820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).