(4-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-3-ylmethanone

C11H18N2O2 — CID 114409350

IUPAC(4-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-3-ylmethanone
SMILESCC1=CCN(C(=O)C2COCCN2)CC1
InChIInChI=1S/C11H18N2O2/c1-9-2-5-13(6-3-9)11(14)10-8-15-7-4-12-10/h2,10,12H,3-8H2,1H3
InChIKeyVNXMYTZCEFGXEP-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.15
Rot. Bonds1

About (4-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-3-ylmethanone

(4-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-3-ylmethanone (PubChem CID 114409350) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is (4-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-3-ylmethanone.

Molecular Properties

Compound Name(4-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-3-ylmethanone
PubChem CID114409350
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name(4-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-3-ylmethanone
SMILESCC1=CCN(C(=O)C2COCCN2)CC1
InChIInChI=1S/C11H18N2O2/c1-9-2-5-13(6-3-9)11(14)10-8-15-7-4-12-10/h2,10,12H,3-8H2,1H3
InChIKeyVNXMYTZCEFGXEP-UHFFFAOYSA-N
XLogP0.15
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

3-Methyl-2-(3-methylbut-2-enylamino)-1-morpholin-4-ylbutan-1-one
CID 75443118
2-[[(2S)-6-methylhept-5-en-2-yl]amino]-1-morpholin-4-ylethanone
CID 97336858
(2S)-N-methyl-N-(2-morpholin-4-ylethyl)-2,5-dihydro-1H-pyrrole-2-carboxamide
CID 171359447
morpholin-3-yl-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone
CID 114489846
1-[3-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridine-1-carbonyl]morpholin-4-yl]ethanone
CID 137843298
(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-morpholin-3-ylmethanone
CID 166234999
N-[(1-{2-[(2R*,6S*)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl}-1,2,5,6-tetrahydropyridin-3-yl)methyl]acetamide
CID 50952420
N-(1-{[1-(2-ethoxyethyl)-1,2,5,6-tetrahydropyridin-3-yl]methyl}piperidin-3-yl)acetamide
CID 50961460
(Z)-2-methyl-N-(1-morpholin-4-ylpropan-2-yl)pent-2-enamide
CID 51080936
4-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl]morpholine-3-carboxamide
CID 89700424
(2R)-2-acetamido-N-(cyclohexa-1,5-dien-1-ylmethyl)-3-methoxypropanamide
CID 90261543
2-acetamido-N-(2-ethylidenepent-3-enyl)-3-methoxypropanamide
CID 123602723

Frequently Asked Questions

What is the IUPAC name of (4-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-3-ylmethanone?
The IUPAC name of (4-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-3-ylmethanone (CID 114409350) is (4-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-3-ylmethanone.
What is the SMILES notation for (4-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-3-ylmethanone?
The canonical SMILES for (4-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-3-ylmethanone is CC1=CCN(C(=O)C2COCCN2)CC1.
What is the InChIKey of (4-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-3-ylmethanone?
The InChIKey is VNXMYTZCEFGXEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-9-2-5-13(6-3-9)11(14)10-8-15-7-4-12-10/h2,10,12H,3-8H2,1H3.
What are the key properties of (4-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-3-ylmethanone?
(4-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-3-ylmethanone has a molecular weight of 210.28 g/mol, XLogP of 0.15, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-3-ylmethanone is sourced from PubChem (CID 114409350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).