N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-N-methylprop-2-enamide

C13H24N2O2 — CID 126814857

IUPACN-(2,2-dimethyl-3-morpholin-4-ylpropyl)-N-methylprop-2-enamide
SMILESC=CC(=O)N(C)CC(C)(C)CN1CCOCC1
InChIInChI=1S/C13H24N2O2/c1-5-12(16)14(4)10-13(2,3)11-15-6-8-17-9-7-15/h5H,1,6-11H2,2-4H3
InChIKeyBEAYANGQGRRXRQ-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.99
Rot. Bonds5

About N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-N-methylprop-2-enamide

N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-N-methylprop-2-enamide (PubChem CID 126814857) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-N-methylprop-2-enamide.

Molecular Properties

Compound NameN-(2,2-dimethyl-3-morpholin-4-ylpropyl)-N-methylprop-2-enamide
PubChem CID126814857
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC NameN-(2,2-dimethyl-3-morpholin-4-ylpropyl)-N-methylprop-2-enamide
SMILESC=CC(=O)N(C)CC(C)(C)CN1CCOCC1
InChIInChI=1S/C13H24N2O2/c1-5-12(16)14(4)10-13(2,3)11-15-6-8-17-9-7-15/h5H,1,6-11H2,2-4H3
InChIKeyBEAYANGQGRRXRQ-UHFFFAOYSA-N
XLogP0.99
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

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CID 18464106
CID 18464106
CID 19820320
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CID 20574637
CID 20574637
CID 23396070
CID 23396070
CID 43616242
CID 43616242
CID 43616705
CID 43616705
CID 43616758
CID 43616758
CID 43616761
CID 43616761

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-N-methylprop-2-enamide?
The IUPAC name of N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-N-methylprop-2-enamide (CID 126814857) is N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-N-methylprop-2-enamide.
What is the SMILES notation for N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-N-methylprop-2-enamide?
The canonical SMILES for N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-N-methylprop-2-enamide is C=CC(=O)N(C)CC(C)(C)CN1CCOCC1.
What is the InChIKey of N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-N-methylprop-2-enamide?
The InChIKey is BEAYANGQGRRXRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-5-12(16)14(4)10-13(2,3)11-15-6-8-17-9-7-15/h5H,1,6-11H2,2-4H3.
What are the key properties of N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-N-methylprop-2-enamide?
N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-N-methylprop-2-enamide has a molecular weight of 240.35 g/mol, XLogP of 0.99, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-N-methylprop-2-enamide is sourced from PubChem (CID 126814857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).