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

C11H18N2O2 — CID 106313850

IUPAC(5-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-2-ylmethanone
SMILESCC1=CCCN(C(=O)C2CNCCO2)C1
InChIInChI=1S/C11H18N2O2/c1-9-3-2-5-13(8-9)11(14)10-7-12-4-6-15-10/h3,10,12H,2,4-8H2,1H3
InChIKeyMKKOPRBLWJFAON-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.15
Rot. Bonds1

About (5-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-2-ylmethanone

(5-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-2-ylmethanone (PubChem CID 106313850) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is (5-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-2-ylmethanone.

Molecular Properties

Compound Name(5-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-2-ylmethanone
PubChem CID106313850
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name(5-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-2-ylmethanone
SMILESCC1=CCCN(C(=O)C2CNCCO2)C1
InChIInChI=1S/C11H18N2O2/c1-9-3-2-5-13(8-9)11(14)10-7-12-4-6-15-10/h3,10,12H,2,4-8H2,1H3
InChIKeyMKKOPRBLWJFAON-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-amino-2-methoxy-1-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]propan-1-one
CID 106113964
morpholin-2-yl-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone
CID 114489929
(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-morpholin-2-ylmethanone
CID 167866900
N-[(1-{2-[(2R*,6S*)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl}-1,2,5,6-tetrahydropyridin-3-yl)methyl]acetamide
CID 50952420
2,6-dimethyl-N-prop-2-enylmorpholine-2-carboxamide
CID 70394900
3-(2-methoxyethylamino)-1-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)propan-1-one
CID 71286421
4-[(2E,5Z)-2-ethyl-6-(methylamino)hepta-2,5-dienyl]morpholin-3-one
CID 134406135
(3-methyl-2H-pyridin-1-yl)-morpholin-2-ylmethanone
CID 174546605
6-(Aminomethyl)-4-[2-(cyclohexen-1-yl)ethyl]-2,2-dimethylmorpholin-3-one
CID 24262276
N,N-bis(prop-2-enyl)morpholine-2-carboxamide
CID 61735697
N-ethyl-N-(2-methylprop-2-enyl)morpholine-2-carboxamide
CID 61735698
N-[2-(cyclohexen-1-yl)ethyl]morpholine-2-carboxamide
CID 61737073

Frequently Asked Questions

What is the IUPAC name of (5-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-2-ylmethanone?
The IUPAC name of (5-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-2-ylmethanone (CID 106313850) is (5-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-2-ylmethanone.
What is the SMILES notation for (5-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-2-ylmethanone?
The canonical SMILES for (5-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-2-ylmethanone is CC1=CCCN(C(=O)C2CNCCO2)C1.
What is the InChIKey of (5-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-2-ylmethanone?
The InChIKey is MKKOPRBLWJFAON-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-9-3-2-5-13(8-9)11(14)10-7-12-4-6-15-10/h3,10,12H,2,4-8H2,1H3.
What are the key properties of (5-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-2-ylmethanone?
(5-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-2-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 (5-methyl-3,6-dihydro-2H-pyridin-1-yl)-morpholin-2-ylmethanone is sourced from PubChem (CID 106313850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).