(4-methylmorpholin-3-yl)-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)methanone

C14H24N2O2 — CID 176979331

IUPAC(4-methylmorpholin-3-yl)-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)methanone
SMILESCC(C)C1=CCN(C(=O)C2COCCN2C)CC1
InChIInChI=1S/C14H24N2O2/c1-11(2)12-4-6-16(7-5-12)14(17)13-10-18-9-8-15(13)3/h4,11,13H,5-10H2,1-3H3
InChIKeyACJXZOQBUZLSIM-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.13
Rot. Bonds2

About (4-methylmorpholin-3-yl)-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)methanone

(4-methylmorpholin-3-yl)-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)methanone (PubChem CID 176979331) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is (4-methylmorpholin-3-yl)-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)methanone.

Molecular Properties

Compound Name(4-methylmorpholin-3-yl)-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)methanone
PubChem CID176979331
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name(4-methylmorpholin-3-yl)-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)methanone
SMILESCC(C)C1=CCN(C(=O)C2COCCN2C)CC1
InChIInChI=1S/C14H24N2O2/c1-11(2)12-4-6-16(7-5-12)14(17)13-10-18-9-8-15(13)3/h4,11,13H,5-10H2,1-3H3
InChIKeyACJXZOQBUZLSIM-UHFFFAOYSA-N
XLogP1.13
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (4-methylmorpholin-3-yl)-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)methanone?
The IUPAC name of (4-methylmorpholin-3-yl)-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)methanone (CID 176979331) is (4-methylmorpholin-3-yl)-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)methanone.
What is the SMILES notation for (4-methylmorpholin-3-yl)-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)methanone?
The canonical SMILES for (4-methylmorpholin-3-yl)-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)methanone is CC(C)C1=CCN(C(=O)C2COCCN2C)CC1.
What is the InChIKey of (4-methylmorpholin-3-yl)-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)methanone?
The InChIKey is ACJXZOQBUZLSIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-11(2)12-4-6-16(7-5-12)14(17)13-10-18-9-8-15(13)3/h4,11,13H,5-10H2,1-3H3.
What are the key properties of (4-methylmorpholin-3-yl)-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)methanone?
(4-methylmorpholin-3-yl)-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)methanone has a molecular weight of 252.36 g/mol, XLogP of 1.13, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylmorpholin-3-yl)-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)methanone is sourced from PubChem (CID 176979331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).