2-(3,5-dimethylmorpholin-4-yl)ethanamine;1-methylpyrrolidin-3-amine

C13H30N4O — CID 158976297

IUPAC2-(3,5-dimethylmorpholin-4-yl)ethanamine;1-methylpyrrolidin-3-amine
SMILESCC1COCC(C)N1CCN.CN1CCC(N)C1
InChIInChI=1S/C8H18N2O.C5H12N2/c1-7-5-11-6-8(2)10(7)4-3-9;1-7-3-2-5(6)4-7/h7-8H,3-6,9H2,1-2H3;5H,2-4,6H2,1H3
InChIKeyJOKZYUGMPXYPNB-UHFFFAOYSA-N
MW258.41 g/mol
LogP-0.30
Rot. Bonds2

About 2-(3,5-dimethylmorpholin-4-yl)ethanamine;1-methylpyrrolidin-3-amine

2-(3,5-dimethylmorpholin-4-yl)ethanamine;1-methylpyrrolidin-3-amine (PubChem CID 158976297) has the molecular formula C13H30N4O and a molecular weight of 258.41 g/mol. Its IUPAC name is 2-(3,5-dimethylmorpholin-4-yl)ethanamine;1-methylpyrrolidin-3-amine.

Molecular Properties

Compound Name2-(3,5-dimethylmorpholin-4-yl)ethanamine;1-methylpyrrolidin-3-amine
PubChem CID158976297
Molecular FormulaC13H30N4O
Molecular Weight258.41 g/mol
Exact Mass258.24
IUPAC Name2-(3,5-dimethylmorpholin-4-yl)ethanamine;1-methylpyrrolidin-3-amine
SMILESCC1COCC(C)N1CCN.CN1CCC(N)C1
InChIInChI=1S/C8H18N2O.C5H12N2/c1-7-5-11-6-8(2)10(7)4-3-9;1-7-3-2-5(6)4-7/h7-8H,3-6,9H2,1-2H3;5H,2-4,6H2,1H3
InChIKeyJOKZYUGMPXYPNB-UHFFFAOYSA-N
XLogP-0.30
TPSA67.75 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-methylpyrrolidin-3-amine;sulfanol
CID 143564913
(3S,5S)-4-(2-chloroethyl)-3,5-dimethylmorpholine;hydrochloride
CID 69418164
1-(trideuteriomethyl)pyrrolidin-3-amine
CID 171034745
2-(2,4-dimethylpiperazin-1-yl)ethanamine
CID 66568123
ethane;1-methylpiperidin-4-amine
CID 123622295
2-[4-(1-methylpyrrolidin-3-yl)piperidin-1-yl]ethanamine
CID 116962889
5-(3,5-dimethylmorpholin-4-yl)pentan-1-ol
CID 111452494
3-(3,5-dimethylmorpholin-4-yl)propanoic acid
CID 130723186
ethane;4-methyl-1,4-oxazepan-6-amine
CID 178036626
(1,3-dimethylpiperidin-4-yl)methanamine
CID 55285263
(3R,4R)-1,3-dimethylpiperidin-4-amine
CID 98186941
2-(2-methylazetidin-1-yl)ethanamine
CID 79677018

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylmorpholin-4-yl)ethanamine;1-methylpyrrolidin-3-amine?
The IUPAC name of 2-(3,5-dimethylmorpholin-4-yl)ethanamine;1-methylpyrrolidin-3-amine (CID 158976297) is 2-(3,5-dimethylmorpholin-4-yl)ethanamine;1-methylpyrrolidin-3-amine.
What is the SMILES notation for 2-(3,5-dimethylmorpholin-4-yl)ethanamine;1-methylpyrrolidin-3-amine?
The canonical SMILES for 2-(3,5-dimethylmorpholin-4-yl)ethanamine;1-methylpyrrolidin-3-amine is CC1COCC(C)N1CCN.CN1CCC(N)C1.
What is the InChIKey of 2-(3,5-dimethylmorpholin-4-yl)ethanamine;1-methylpyrrolidin-3-amine?
The InChIKey is JOKZYUGMPXYPNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O.C5H12N2/c1-7-5-11-6-8(2)10(7)4-3-9;1-7-3-2-5(6)4-7/h7-8H,3-6,9H2,1-2H3;5H,2-4,6H2,1H3.
What are the key properties of 2-(3,5-dimethylmorpholin-4-yl)ethanamine;1-methylpyrrolidin-3-amine?
2-(3,5-dimethylmorpholin-4-yl)ethanamine;1-methylpyrrolidin-3-amine has a molecular weight of 258.41 g/mol, XLogP of -0.30, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylmorpholin-4-yl)ethanamine;1-methylpyrrolidin-3-amine is sourced from PubChem (CID 158976297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).