N-[3-(2,6-dimethylmorpholin-4-yl)propyl]-2-methylpropan-2-amine

C13H28N2O — CID 60851499

IUPACN-[3-(2,6-dimethylmorpholin-4-yl)propyl]-2-methylpropan-2-amine
SMILESCC1CN(CCCNC(C)(C)C)CC(C)O1
InChIInChI=1S/C13H28N2O/c1-11-9-15(10-12(2)16-11)8-6-7-14-13(3,4)5/h11-12,14H,6-10H2,1-5H3
InChIKeyMTYJSYXQBIAHNH-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.87
Rot. Bonds4

About N-[3-(2,6-dimethylmorpholin-4-yl)propyl]-2-methylpropan-2-amine

N-[3-(2,6-dimethylmorpholin-4-yl)propyl]-2-methylpropan-2-amine (PubChem CID 60851499) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is N-[3-(2,6-dimethylmorpholin-4-yl)propyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[3-(2,6-dimethylmorpholin-4-yl)propyl]-2-methylpropan-2-amine
PubChem CID60851499
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC NameN-[3-(2,6-dimethylmorpholin-4-yl)propyl]-2-methylpropan-2-amine
SMILESCC1CN(CCCNC(C)(C)C)CC(C)O1
InChIInChI=1S/C13H28N2O/c1-11-9-15(10-12(2)16-11)8-6-7-14-13(3,4)5/h11-12,14H,6-10H2,1-5H3
InChIKeyMTYJSYXQBIAHNH-UHFFFAOYSA-N
XLogP1.87
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-tert-butyl-4-(3,4-dimethylpyrrolidin-1-yl)butan-1-amine
CID 79184508
N-tert-butyl-5-(3,5-dimethylpiperidin-1-yl)pentan-1-amine
CID 55070235
4-(2,6-dimethylmorpholin-4-yl)-N-methylbutan-1-amine
CID 60842262
N-[3-[(2S,6S)-2,6-dimethylmorpholin-4-yl]propyl]ethanesulfonamide
CID 94181344
N-[3-(3,4-dimethylpiperazin-1-yl)propyl]-2-methylpropan-2-amine
CID 63609125
N-[4-[(2S,6S)-2,6-dimethylmorpholin-4-yl]butyl]ethanesulfonamide
CID 97058705
N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-3,3-dimethylbutan-1-amine
CID 55085604
N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]butyl]cyclopropanamine
CID 104960941
1-[3-(2,6-dimethylmorpholin-4-yl)propyl]-2-methylguanidine;hydroiodide
CID 51131455
2,6-dimethyl-4-tritriacontylmorpholine
CID 150123657
2-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]acetamide
CID 119841025
1-[3-(tert-butylamino)propyl]-3-methylpiperidin-4-ol
CID 114681079

Frequently Asked Questions

What is the IUPAC name of N-[3-(2,6-dimethylmorpholin-4-yl)propyl]-2-methylpropan-2-amine?
The IUPAC name of N-[3-(2,6-dimethylmorpholin-4-yl)propyl]-2-methylpropan-2-amine (CID 60851499) is N-[3-(2,6-dimethylmorpholin-4-yl)propyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[3-(2,6-dimethylmorpholin-4-yl)propyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[3-(2,6-dimethylmorpholin-4-yl)propyl]-2-methylpropan-2-amine is CC1CN(CCCNC(C)(C)C)CC(C)O1.
What is the InChIKey of N-[3-(2,6-dimethylmorpholin-4-yl)propyl]-2-methylpropan-2-amine?
The InChIKey is MTYJSYXQBIAHNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-11-9-15(10-12(2)16-11)8-6-7-14-13(3,4)5/h11-12,14H,6-10H2,1-5H3.
What are the key properties of N-[3-(2,6-dimethylmorpholin-4-yl)propyl]-2-methylpropan-2-amine?
N-[3-(2,6-dimethylmorpholin-4-yl)propyl]-2-methylpropan-2-amine has a molecular weight of 228.38 g/mol, XLogP of 1.87, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2,6-dimethylmorpholin-4-yl)propyl]-2-methylpropan-2-amine is sourced from PubChem (CID 60851499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).