N-(2-morpholin-4-ylpropyl)hexan-2-amine

C13H28N2O — CID 115708396

IUPACN-(2-morpholin-4-ylpropyl)hexan-2-amine
SMILESCCCCC(C)NCC(C)N1CCOCC1
InChIInChI=1S/C13H28N2O/c1-4-5-6-12(2)14-11-13(3)15-7-9-16-10-8-15/h12-14H,4-11H2,1-3H3
InChIKeyCJKFXHXTDXBHIA-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.88
Rot. Bonds7

About N-(2-morpholin-4-ylpropyl)hexan-2-amine

N-(2-morpholin-4-ylpropyl)hexan-2-amine (PubChem CID 115708396) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is N-(2-morpholin-4-ylpropyl)hexan-2-amine.

Molecular Properties

Compound NameN-(2-morpholin-4-ylpropyl)hexan-2-amine
PubChem CID115708396
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC NameN-(2-morpholin-4-ylpropyl)hexan-2-amine
SMILESCCCCC(C)NCC(C)N1CCOCC1
InChIInChI=1S/C13H28N2O/c1-4-5-6-12(2)14-11-13(3)15-7-9-16-10-8-15/h12-14H,4-11H2,1-3H3
InChIKeyCJKFXHXTDXBHIA-UHFFFAOYSA-N
XLogP1.88
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(2S)-hexan-2-yl]morpholine
CID 124506548
3-methyl-N-(2-morpholin-4-ylpropyl)pentan-2-amine
CID 115708392
N-ethyl-4-morpholin-4-ylpentan-2-amine
CID 64706123
N-(3-methyl-2-pyrrolidin-1-ylbutyl)hexan-2-amine
CID 43771611
1-ethyl-3-heptan-2-yl-2-(2-morpholin-4-ylpropyl)guanidine
CID 111195780
4-[(2R)-1-[[butyl(methyl)sulfamoyl]amino]propan-2-yl]morpholine
CID 94802927
4-[1-[[butyl(methyl)sulfamoyl]amino]propan-2-yl]morpholine
CID 51079505
2-methyl-N-(2-morpholin-4-ylpropyl)butan-2-amine
CID 62556601
1-N-hexan-2-ylpropane-1,2-diamine
CID 62201000
(2S)-N-(2,3-dimethylbutyl)hexan-2-amine
CID 134386655
4-hexadecan-8-ylmorpholine
CID 126489366
N-pentan-2-ylmorpholin-4-amine
CID 83010850

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylpropyl)hexan-2-amine?
The IUPAC name of N-(2-morpholin-4-ylpropyl)hexan-2-amine (CID 115708396) is N-(2-morpholin-4-ylpropyl)hexan-2-amine.
What is the SMILES notation for N-(2-morpholin-4-ylpropyl)hexan-2-amine?
The canonical SMILES for N-(2-morpholin-4-ylpropyl)hexan-2-amine is CCCCC(C)NCC(C)N1CCOCC1.
What is the InChIKey of N-(2-morpholin-4-ylpropyl)hexan-2-amine?
The InChIKey is CJKFXHXTDXBHIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-4-5-6-12(2)14-11-13(3)15-7-9-16-10-8-15/h12-14H,4-11H2,1-3H3.
What are the key properties of N-(2-morpholin-4-ylpropyl)hexan-2-amine?
N-(2-morpholin-4-ylpropyl)hexan-2-amine has a molecular weight of 228.38 g/mol, XLogP of 1.88, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylpropyl)hexan-2-amine is sourced from PubChem (CID 115708396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).