1-[(2,5-dimethylmorpholin-4-yl)methyl]cyclohexan-1-amine

C13H26N2O — CID 43544729

IUPAC1-[(2,5-dimethylmorpholin-4-yl)methyl]cyclohexan-1-amine
SMILESCC1CN(CC2(N)CCCCC2)C(C)CO1
InChIInChI=1S/C13H26N2O/c1-11-9-16-12(2)8-15(11)10-13(14)6-4-3-5-7-13/h11-12H,3-10,14H2,1-2H3
InChIKeyXYHNCNYAHGDOBW-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.76
Rot. Bonds2

About 1-[(2,5-dimethylmorpholin-4-yl)methyl]cyclohexan-1-amine

1-[(2,5-dimethylmorpholin-4-yl)methyl]cyclohexan-1-amine (PubChem CID 43544729) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 1-[(2,5-dimethylmorpholin-4-yl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name1-[(2,5-dimethylmorpholin-4-yl)methyl]cyclohexan-1-amine
PubChem CID43544729
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name1-[(2,5-dimethylmorpholin-4-yl)methyl]cyclohexan-1-amine
SMILESCC1CN(CC2(N)CCCCC2)C(C)CO1
InChIInChI=1S/C13H26N2O/c1-11-9-16-12(2)8-15(11)10-13(14)6-4-3-5-7-13/h11-12H,3-10,14H2,1-2H3
InChIKeyXYHNCNYAHGDOBW-UHFFFAOYSA-N
XLogP1.76
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-[(2,5-dimethylmorpholin-4-yl)methyl]cyclopentyl]methyl]ethanamine
CID 62257854
N-[[1-[(2,5-dimethylmorpholin-4-yl)methyl]cyclopentyl]methyl]-2-methylpropan-2-amine
CID 62258028
(2R,5S)-N-[(1-aminocycloheptyl)methyl]-2,5-dimethylmorpholine-4-sulfonamide
CID 124692525
2-[(2,5-dimethylmorpholin-4-yl)methyl]cycloheptan-1-amine
CID 62615947
4-[(3-ethylpyrrolidin-3-yl)methyl]-2,5-dimethylmorpholine
CID 63142734
4-[(4-ethylpiperidin-4-yl)methyl]-2,5-dimethylmorpholine
CID 63129246
2-(1-aminocyclobutyl)-1-(2,5-dimethylmorpholin-4-yl)ethanone
CID 79851814
[1-(2,5-dimethylmorpholin-4-yl)cycloheptyl]methanamine
CID 43544407
1-[(2-methylpyrrolidin-1-yl)methyl]cyclopentan-1-amine
CID 60973694
1-[3-[(2,5-dimethylmorpholin-4-yl)methyl]oxan-3-yl]-N-methylmethanamine
CID 63739595
[1-amino-2-[2-(2,5-dimethylmorpholin-4-yl)ethyl]cyclopentyl]methanol
CID 79571094
4-(2-iodoethyl)-2,5-dimethylmorpholine
CID 130977867

Frequently Asked Questions

What is the IUPAC name of 1-[(2,5-dimethylmorpholin-4-yl)methyl]cyclohexan-1-amine?
The IUPAC name of 1-[(2,5-dimethylmorpholin-4-yl)methyl]cyclohexan-1-amine (CID 43544729) is 1-[(2,5-dimethylmorpholin-4-yl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 1-[(2,5-dimethylmorpholin-4-yl)methyl]cyclohexan-1-amine?
The canonical SMILES for 1-[(2,5-dimethylmorpholin-4-yl)methyl]cyclohexan-1-amine is CC1CN(CC2(N)CCCCC2)C(C)CO1.
What is the InChIKey of 1-[(2,5-dimethylmorpholin-4-yl)methyl]cyclohexan-1-amine?
The InChIKey is XYHNCNYAHGDOBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-11-9-16-12(2)8-15(11)10-13(14)6-4-3-5-7-13/h11-12H,3-10,14H2,1-2H3.
What are the key properties of 1-[(2,5-dimethylmorpholin-4-yl)methyl]cyclohexan-1-amine?
1-[(2,5-dimethylmorpholin-4-yl)methyl]cyclohexan-1-amine has a molecular weight of 226.36 g/mol, XLogP of 1.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,5-dimethylmorpholin-4-yl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 43544729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).