[6,6-dimethyl-4-[2-(1-methylpiperidin-2-yl)ethyl]morpholin-2-yl]methanamine

C15H31N3O — CID 107914161

IUPAC[6,6-dimethyl-4-[2-(1-methylpiperidin-2-yl)ethyl]morpholin-2-yl]methanamine
SMILESCN1CCCCC1CCN1CC(CN)OC(C)(C)C1
InChIInChI=1S/C15H31N3O/c1-15(2)12-18(11-14(10-16)19-15)9-7-13-6-4-5-8-17(13)3/h13-14H,4-12,16H2,1-3H3
InChIKeyXPPHHFNNHFXDIU-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.30
Rot. Bonds4

About [6,6-dimethyl-4-[2-(1-methylpiperidin-2-yl)ethyl]morpholin-2-yl]methanamine

[6,6-dimethyl-4-[2-(1-methylpiperidin-2-yl)ethyl]morpholin-2-yl]methanamine (PubChem CID 107914161) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is [6,6-dimethyl-4-[2-(1-methylpiperidin-2-yl)ethyl]morpholin-2-yl]methanamine.

Molecular Properties

Compound Name[6,6-dimethyl-4-[2-(1-methylpiperidin-2-yl)ethyl]morpholin-2-yl]methanamine
PubChem CID107914161
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC Name[6,6-dimethyl-4-[2-(1-methylpiperidin-2-yl)ethyl]morpholin-2-yl]methanamine
SMILESCN1CCCCC1CCN1CC(CN)OC(C)(C)C1
InChIInChI=1S/C15H31N3O/c1-15(2)12-18(11-14(10-16)19-15)9-7-13-6-4-5-8-17(13)3/h13-14H,4-12,16H2,1-3H3
InChIKeyXPPHHFNNHFXDIU-UHFFFAOYSA-N
XLogP1.30
TPSA41.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [6,6-dimethyl-4-[2-(1-methylpiperidin-2-yl)ethyl]morpholin-2-yl]methanamine?
The IUPAC name of [6,6-dimethyl-4-[2-(1-methylpiperidin-2-yl)ethyl]morpholin-2-yl]methanamine (CID 107914161) is [6,6-dimethyl-4-[2-(1-methylpiperidin-2-yl)ethyl]morpholin-2-yl]methanamine.
What is the SMILES notation for [6,6-dimethyl-4-[2-(1-methylpiperidin-2-yl)ethyl]morpholin-2-yl]methanamine?
The canonical SMILES for [6,6-dimethyl-4-[2-(1-methylpiperidin-2-yl)ethyl]morpholin-2-yl]methanamine is CN1CCCCC1CCN1CC(CN)OC(C)(C)C1.
What is the InChIKey of [6,6-dimethyl-4-[2-(1-methylpiperidin-2-yl)ethyl]morpholin-2-yl]methanamine?
The InChIKey is XPPHHFNNHFXDIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-15(2)12-18(11-14(10-16)19-15)9-7-13-6-4-5-8-17(13)3/h13-14H,4-12,16H2,1-3H3.
What are the key properties of [6,6-dimethyl-4-[2-(1-methylpiperidin-2-yl)ethyl]morpholin-2-yl]methanamine?
[6,6-dimethyl-4-[2-(1-methylpiperidin-2-yl)ethyl]morpholin-2-yl]methanamine has a molecular weight of 269.43 g/mol, XLogP of 1.30, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6,6-dimethyl-4-[2-(1-methylpiperidin-2-yl)ethyl]morpholin-2-yl]methanamine is sourced from PubChem (CID 107914161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).