N-[1-(2,2-dimethyl-3-morpholin-4-yl-3-oxopropoxy)-3-hydroxy-2-methylpropan-2-yl]-2,2-dimethylpropanamide

C18H34N2O5 — CID 135224218

IUPACN-[1-(2,2-dimethyl-3-morpholin-4-yl-3-oxopropoxy)-3-hydroxy-2-methylpropan-2-yl]-2,2-dimethylpropanamide
SMILESCC(CO)(COCC(C)(C)C(=O)N1CCOCC1)NC(=O)C(C)(C)C
InChIInChI=1S/C18H34N2O5/c1-16(2,3)14(22)19-18(6,11-21)13-25-12-17(4,5)15(23)20-7-9-24-10-8-20/h21H,7-13H2,1-6H3,(H,19,22)
InChIKeyKPUUQWJEUXRKIC-UHFFFAOYSA-N
MW358.48 g/mol
LogP0.80
Rot. Bonds7

About N-[1-(2,2-dimethyl-3-morpholin-4-yl-3-oxopropoxy)-3-hydroxy-2-methylpropan-2-yl]-2,2-dimethylpropanamide

N-[1-(2,2-dimethyl-3-morpholin-4-yl-3-oxopropoxy)-3-hydroxy-2-methylpropan-2-yl]-2,2-dimethylpropanamide (PubChem CID 135224218) has the molecular formula C18H34N2O5 and a molecular weight of 358.48 g/mol. Its IUPAC name is N-[1-(2,2-dimethyl-3-morpholin-4-yl-3-oxopropoxy)-3-hydroxy-2-methylpropan-2-yl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[1-(2,2-dimethyl-3-morpholin-4-yl-3-oxopropoxy)-3-hydroxy-2-methylpropan-2-yl]-2,2-dimethylpropanamide
PubChem CID135224218
Molecular FormulaC18H34N2O5
Molecular Weight358.48 g/mol
Exact Mass358.25
IUPAC NameN-[1-(2,2-dimethyl-3-morpholin-4-yl-3-oxopropoxy)-3-hydroxy-2-methylpropan-2-yl]-2,2-dimethylpropanamide
SMILESCC(CO)(COCC(C)(C)C(=O)N1CCOCC1)NC(=O)C(C)(C)C
InChIInChI=1S/C18H34N2O5/c1-16(2,3)14(22)19-18(6,11-21)13-25-12-17(4,5)15(23)20-7-9-24-10-8-20/h21H,7-13H2,1-6H3,(H,19,22)
InChIKeyKPUUQWJEUXRKIC-UHFFFAOYSA-N
XLogP0.80
TPSA88.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.48
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[1-(2,2-dimethyl-3-morpholin-4-yl-3-oxopropoxy)-3-hydroxy-2-methylpropan-2-yl]-2,2-dimethylpropanamide with MolForge

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Related Compounds

N-(3,3-dimethyl-4-morpholin-4-yl-4-oxobutyl)-N,2,2-trimethylpropanamide
CID 126763695
2,2-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)propanamide
CID 47009992
3-chloro-2,2-dimethyl-1-(1,4-oxazepan-4-yl)propan-1-one
CID 63663845
ethane;2-methyl-2-(methylamino)-1-morpholin-4-ylpropan-1-one
CID 168940917
2,2-difluoro-3-methoxy-1-morpholin-4-ylpropan-1-one
CID 139403937
N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]morpholine-4-carboxamide
CID 103749296
2,2,3-trimethyl-1-morpholin-4-ylbutan-1-one
CID 23551857
3,3-dimethyl-1-morpholin-4-ylbutane-1,2-dione
CID 58498578
N-(3,3-dimethyl-2-oxobutyl)morpholine-4-carboxamide
CID 79152144
2-(3-methylpentan-3-ylamino)-1-morpholin-4-ylethanone
CID 103746720
methyl morpholine-4-carboxylate
CID 12575354
3-[(3-hydroxy-2,2-dimethylpropyl)amino]-1-morpholin-4-ylpropan-1-one
CID 113411282

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,2-dimethyl-3-morpholin-4-yl-3-oxopropoxy)-3-hydroxy-2-methylpropan-2-yl]-2,2-dimethylpropanamide?
The IUPAC name of N-[1-(2,2-dimethyl-3-morpholin-4-yl-3-oxopropoxy)-3-hydroxy-2-methylpropan-2-yl]-2,2-dimethylpropanamide (CID 135224218) is N-[1-(2,2-dimethyl-3-morpholin-4-yl-3-oxopropoxy)-3-hydroxy-2-methylpropan-2-yl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[1-(2,2-dimethyl-3-morpholin-4-yl-3-oxopropoxy)-3-hydroxy-2-methylpropan-2-yl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[1-(2,2-dimethyl-3-morpholin-4-yl-3-oxopropoxy)-3-hydroxy-2-methylpropan-2-yl]-2,2-dimethylpropanamide is CC(CO)(COCC(C)(C)C(=O)N1CCOCC1)NC(=O)C(C)(C)C.
What is the InChIKey of N-[1-(2,2-dimethyl-3-morpholin-4-yl-3-oxopropoxy)-3-hydroxy-2-methylpropan-2-yl]-2,2-dimethylpropanamide?
The InChIKey is KPUUQWJEUXRKIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2O5/c1-16(2,3)14(22)19-18(6,11-21)13-25-12-17(4,5)15(23)20-7-9-24-10-8-20/h21H,7-13H2,1-6H3,(H,19,22).
What are the key properties of N-[1-(2,2-dimethyl-3-morpholin-4-yl-3-oxopropoxy)-3-hydroxy-2-methylpropan-2-yl]-2,2-dimethylpropanamide?
N-[1-(2,2-dimethyl-3-morpholin-4-yl-3-oxopropoxy)-3-hydroxy-2-methylpropan-2-yl]-2,2-dimethylpropanamide has a molecular weight of 358.48 g/mol, XLogP of 0.80, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,2-dimethyl-3-morpholin-4-yl-3-oxopropoxy)-3-hydroxy-2-methylpropan-2-yl]-2,2-dimethylpropanamide is sourced from PubChem (CID 135224218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).