6-amino-1-(2,6-dimethylmorpholin-4-yl)-4,4-dimethylhexan-1-one

C14H28N2O2 — CID 65293281

IUPAC6-amino-1-(2,6-dimethylmorpholin-4-yl)-4,4-dimethylhexan-1-one
SMILESCC1CN(C(=O)CCC(C)(C)CCN)CC(C)O1
InChIInChI=1S/C14H28N2O2/c1-11-9-16(10-12(2)18-11)13(17)5-6-14(3,4)7-8-15/h11-12H,5-10,15H2,1-4H3
InChIKeyQJAMNHYHDHFEAS-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.78
Rot. Bonds5

About 6-amino-1-(2,6-dimethylmorpholin-4-yl)-4,4-dimethylhexan-1-one

6-amino-1-(2,6-dimethylmorpholin-4-yl)-4,4-dimethylhexan-1-one (PubChem CID 65293281) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 6-amino-1-(2,6-dimethylmorpholin-4-yl)-4,4-dimethylhexan-1-one.

Molecular Properties

Compound Name6-amino-1-(2,6-dimethylmorpholin-4-yl)-4,4-dimethylhexan-1-one
PubChem CID65293281
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name6-amino-1-(2,6-dimethylmorpholin-4-yl)-4,4-dimethylhexan-1-one
SMILESCC1CN(C(=O)CCC(C)(C)CCN)CC(C)O1
InChIInChI=1S/C14H28N2O2/c1-11-9-16(10-12(2)18-11)13(17)5-6-14(3,4)7-8-15/h11-12H,5-10,15H2,1-4H3
InChIKeyQJAMNHYHDHFEAS-UHFFFAOYSA-N
XLogP1.78
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-amino-1-(2,6-dimethylmorpholin-4-yl)-4,4-dimethylhexan-1-one with MolForge

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Related Compounds

3-amino-1-(2,6-dimethylmorpholin-4-yl)propan-1-one
CID 16784840
6-amino-1-(4-hydroxypiperidin-1-yl)-4,4-dimethylhexan-1-one
CID 65293101
3-amino-1-(2,6-dimethylmorpholin-4-yl)-3-methylbutan-1-one
CID 64684519
3-amino-1-(2-ethyl-6-methylmorpholin-4-yl)propan-1-one
CID 119304810
1-(6-amino-4,4-dimethylhexanoyl)piperidine-3-carboxamide
CID 65292570
3-(2,6-dimethylmorpholin-4-yl)-3-oxopropanethioamide
CID 43120415
4-(6-amino-4,4-dimethylhexanoyl)-N-ethylpiperazine-1-carboxamide
CID 65290869
6-amino-1-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]-4,4-dimethylhexan-1-one
CID 65291006
1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-methylsulfonylpropan-1-one
CID 131889002
N-[1-(6-amino-4,4-dimethylhexanoyl)piperidin-4-yl]methanesulfonamide
CID 65290824
6-amino-1-(4-ethyl-4-methylpiperidin-1-yl)-4,4-dimethylhexan-1-one
CID 65291232
[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]sulfanium
CID 153278899

Frequently Asked Questions

What is the IUPAC name of 6-amino-1-(2,6-dimethylmorpholin-4-yl)-4,4-dimethylhexan-1-one?
The IUPAC name of 6-amino-1-(2,6-dimethylmorpholin-4-yl)-4,4-dimethylhexan-1-one (CID 65293281) is 6-amino-1-(2,6-dimethylmorpholin-4-yl)-4,4-dimethylhexan-1-one.
What is the SMILES notation for 6-amino-1-(2,6-dimethylmorpholin-4-yl)-4,4-dimethylhexan-1-one?
The canonical SMILES for 6-amino-1-(2,6-dimethylmorpholin-4-yl)-4,4-dimethylhexan-1-one is CC1CN(C(=O)CCC(C)(C)CCN)CC(C)O1.
What is the InChIKey of 6-amino-1-(2,6-dimethylmorpholin-4-yl)-4,4-dimethylhexan-1-one?
The InChIKey is QJAMNHYHDHFEAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-11-9-16(10-12(2)18-11)13(17)5-6-14(3,4)7-8-15/h11-12H,5-10,15H2,1-4H3.
What are the key properties of 6-amino-1-(2,6-dimethylmorpholin-4-yl)-4,4-dimethylhexan-1-one?
6-amino-1-(2,6-dimethylmorpholin-4-yl)-4,4-dimethylhexan-1-one has a molecular weight of 256.39 g/mol, XLogP of 1.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1-(2,6-dimethylmorpholin-4-yl)-4,4-dimethylhexan-1-one is sourced from PubChem (CID 65293281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).