1-[(3R)-3-(5-methylfuran-2-yl)morpholin-4-yl]-2-(3-methyl-4-pyridinyl)ethanone

C17H20N2O3 — CID 124618190

IUPAC1-[(3R)-3-(5-methylfuran-2-yl)morpholin-4-yl]-2-(3-methyl-4-pyridinyl)ethanone
SMILESCc1ccc([C@H]2COCCN2C(=O)Cc2ccncc2C)o1
InChIInChI=1S/C17H20N2O3/c1-12-10-18-6-5-14(12)9-17(20)19-7-8-21-11-15(19)16-4-3-13(2)22-16/h3-6,10,15H,7-9,11H2,1-2H3/t15-/m1/s1
InChIKeyKHFRRMMECZLLGZ-OAHLLOKOSA-N
MW300.36 g/mol
LogP2.43
Rot. Bonds3

About 1-[(3R)-3-(5-methylfuran-2-yl)morpholin-4-yl]-2-(3-methyl-4-pyridinyl)ethanone

1-[(3R)-3-(5-methylfuran-2-yl)morpholin-4-yl]-2-(3-methyl-4-pyridinyl)ethanone (PubChem CID 124618190) has the molecular formula C17H20N2O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is 1-[(3R)-3-(5-methylfuran-2-yl)morpholin-4-yl]-2-(3-methyl-4-pyridinyl)ethanone.

Molecular Properties

Compound Name1-[(3R)-3-(5-methylfuran-2-yl)morpholin-4-yl]-2-(3-methyl-4-pyridinyl)ethanone
PubChem CID124618190
Molecular FormulaC17H20N2O3
Molecular Weight300.36 g/mol
Exact Mass300.15
IUPAC Name1-[(3R)-3-(5-methylfuran-2-yl)morpholin-4-yl]-2-(3-methyl-4-pyridinyl)ethanone
SMILESCc1ccc([C@H]2COCCN2C(=O)Cc2ccncc2C)o1
InChIInChI=1S/C17H20N2O3/c1-12-10-18-6-5-14(12)9-17(20)19-7-8-21-11-15(19)16-4-3-13(2)22-16/h3-6,10,15H,7-9,11H2,1-2H3/t15-/m1/s1
InChIKeyKHFRRMMECZLLGZ-OAHLLOKOSA-N
XLogP2.43
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[(3R)-3-(5-methylfuran-2-yl)morpholin-4-yl]-2-(3-methyl-4-pyridinyl)ethanone with MolForge

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Related Compounds

2-[3-(5-methylfuran-2-yl)morpholine-4-carbonyl]cyclobutane-1-carboxylic acid
CID 120976917
2-methyl-6-[(3S)-3-(5-methylfuran-2-yl)morpholine-4-carbonyl]pyridazin-3-one
CID 97071367
2-(3-methyl-4-pyridinyl)-1-[(2S)-2-(5-methyl-1H-1,2,4-triazol-3-yl)piperidin-1-yl]ethanone
CID 129492191
[3-(5-methylfuran-2-yl)morpholin-4-yl]-[3-(trifluoromethyl)cyclohexyl]methanone
CID 71875631
[(3S)-3-(5-methylfuran-2-yl)morpholin-4-yl]-[(1S,3R)-3-(trifluoromethyl)cyclohexyl]methanone
CID 100857610
3-(5-methylfuran-2-yl)-N-[1-(oxolan-3-yloxy)propan-2-yl]morpholine-4-carboxamide
CID 136513663
[(3R)-3-(5-methylfuran-2-yl)morpholin-4-yl]-(4-methyl-3-nitrophenyl)methanone
CID 97317232
1-[3-(4-fluorophenyl)morpholin-4-yl]-2-(2-methylphenyl)ethanone
CID 110663868
2-[3-(5-ethylfuran-2-yl)morpholine-4-carbonyl]cyclopropane-1-carboxylic acid
CID 119185554
3-(5-methylfuran-2-yl)-N-(2,4,5-trifluorophenyl)morpholine-4-carboxamide
CID 86799712
1-[(2R,5R)-5-methyl-2-phenylmorpholin-4-yl]-2-(3-methyl-4-pyridinyl)ethanone
CID 124619460
3-(5-methylfuran-2-yl)-N-(4-propyl-1,3-thiazol-2-yl)morpholine-4-carboxamide
CID 86799955

Frequently Asked Questions

What is the IUPAC name of 1-[(3R)-3-(5-methylfuran-2-yl)morpholin-4-yl]-2-(3-methyl-4-pyridinyl)ethanone?
The IUPAC name of 1-[(3R)-3-(5-methylfuran-2-yl)morpholin-4-yl]-2-(3-methyl-4-pyridinyl)ethanone (CID 124618190) is 1-[(3R)-3-(5-methylfuran-2-yl)morpholin-4-yl]-2-(3-methyl-4-pyridinyl)ethanone.
What is the SMILES notation for 1-[(3R)-3-(5-methylfuran-2-yl)morpholin-4-yl]-2-(3-methyl-4-pyridinyl)ethanone?
The canonical SMILES for 1-[(3R)-3-(5-methylfuran-2-yl)morpholin-4-yl]-2-(3-methyl-4-pyridinyl)ethanone is Cc1ccc([C@H]2COCCN2C(=O)Cc2ccncc2C)o1.
What is the InChIKey of 1-[(3R)-3-(5-methylfuran-2-yl)morpholin-4-yl]-2-(3-methyl-4-pyridinyl)ethanone?
The InChIKey is KHFRRMMECZLLGZ-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H20N2O3/c1-12-10-18-6-5-14(12)9-17(20)19-7-8-21-11-15(19)16-4-3-13(2)22-16/h3-6,10,15H,7-9,11H2,1-2H3/t15-/m1/s1.
What are the key properties of 1-[(3R)-3-(5-methylfuran-2-yl)morpholin-4-yl]-2-(3-methyl-4-pyridinyl)ethanone?
1-[(3R)-3-(5-methylfuran-2-yl)morpholin-4-yl]-2-(3-methyl-4-pyridinyl)ethanone has a molecular weight of 300.36 g/mol, XLogP of 2.43, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3R)-3-(5-methylfuran-2-yl)morpholin-4-yl]-2-(3-methyl-4-pyridinyl)ethanone is sourced from PubChem (CID 124618190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).