2-(3,3-dimethylmorpholin-4-yl)-N-methylpentan-1-amine

C12H26N2O — CID 83053918

IUPAC2-(3,3-dimethylmorpholin-4-yl)-N-methylpentan-1-amine
SMILESCCCC(CNC)N1CCOCC1(C)C
InChIInChI=1S/C12H26N2O/c1-5-6-11(9-13-4)14-7-8-15-10-12(14,2)3/h11,13H,5-10H2,1-4H3
InChIKeyZLPVYESPJAUOOA-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.49
Rot. Bonds5

About 2-(3,3-dimethylmorpholin-4-yl)-N-methylpentan-1-amine

2-(3,3-dimethylmorpholin-4-yl)-N-methylpentan-1-amine (PubChem CID 83053918) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 2-(3,3-dimethylmorpholin-4-yl)-N-methylpentan-1-amine.

Molecular Properties

Compound Name2-(3,3-dimethylmorpholin-4-yl)-N-methylpentan-1-amine
PubChem CID83053918
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name2-(3,3-dimethylmorpholin-4-yl)-N-methylpentan-1-amine
SMILESCCCC(CNC)N1CCOCC1(C)C
InChIInChI=1S/C12H26N2O/c1-5-6-11(9-13-4)14-7-8-15-10-12(14,2)3/h11,13H,5-10H2,1-4H3
InChIKeyZLPVYESPJAUOOA-UHFFFAOYSA-N
XLogP1.49
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,3-dimethylmorpholin-4-yl)-N-propylpropan-1-amine
CID 62461496
3-amino-2-(3,3-dimethylmorpholin-4-yl)propan-1-ol
CID 104710885
2-(4,4-dimethylpiperidin-1-yl)-N-methylpentan-1-amine
CID 83053930
N-[2-(3,3-dimethylmorpholin-4-yl)propyl]-2-methylpropan-1-amine
CID 62461681
3-(3,3-dimethylmorpholin-4-yl)-2-methyl-N-(2-methylpropyl)butan-1-amine
CID 81019120
1-(3,3-dimethylmorpholin-4-yl)ethanol
CID 141129564
4-amino-3-(3,3-dimethylmorpholin-4-yl)butanamide
CID 66426683
2-[(3,3-dimethylmorpholine-4-carbonyl)amino]pentanoic acid
CID 61428247
N-methyl-2-(4-propan-2-ylpiperazin-1-yl)pentan-1-amine
CID 83054458
2-(3,3-dimethylmorpholin-4-yl)-3-(2-methoxyethoxy)propan-1-amine
CID 112752590
1-(3,3-dimethylmorpholin-4-yl)-N-methylbutan-2-amine
CID 62038435
N-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-2-methyl-3-(methylamino)propanamide
CID 119876458

Frequently Asked Questions

What is the IUPAC name of 2-(3,3-dimethylmorpholin-4-yl)-N-methylpentan-1-amine?
The IUPAC name of 2-(3,3-dimethylmorpholin-4-yl)-N-methylpentan-1-amine (CID 83053918) is 2-(3,3-dimethylmorpholin-4-yl)-N-methylpentan-1-amine.
What is the SMILES notation for 2-(3,3-dimethylmorpholin-4-yl)-N-methylpentan-1-amine?
The canonical SMILES for 2-(3,3-dimethylmorpholin-4-yl)-N-methylpentan-1-amine is CCCC(CNC)N1CCOCC1(C)C.
What is the InChIKey of 2-(3,3-dimethylmorpholin-4-yl)-N-methylpentan-1-amine?
The InChIKey is ZLPVYESPJAUOOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-5-6-11(9-13-4)14-7-8-15-10-12(14,2)3/h11,13H,5-10H2,1-4H3.
What are the key properties of 2-(3,3-dimethylmorpholin-4-yl)-N-methylpentan-1-amine?
2-(3,3-dimethylmorpholin-4-yl)-N-methylpentan-1-amine has a molecular weight of 214.35 g/mol, XLogP of 1.49, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,3-dimethylmorpholin-4-yl)-N-methylpentan-1-amine is sourced from PubChem (CID 83053918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).