4-(2-ethylmorpholin-4-yl)-3-methylbutan-1-amine

C11H24N2O — CID 80544103

IUPAC4-(2-ethylmorpholin-4-yl)-3-methylbutan-1-amine
SMILESCCC1CN(CC(C)CCN)CCO1
InChIInChI=1S/C11H24N2O/c1-3-11-9-13(6-7-14-11)8-10(2)4-5-12/h10-11H,3-9,12H2,1-2H3
InChIKeyWTISXJMKGHYHNG-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.08
Rot. Bonds5

About 4-(2-ethylmorpholin-4-yl)-3-methylbutan-1-amine

4-(2-ethylmorpholin-4-yl)-3-methylbutan-1-amine (PubChem CID 80544103) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 4-(2-ethylmorpholin-4-yl)-3-methylbutan-1-amine.

Molecular Properties

Compound Name4-(2-ethylmorpholin-4-yl)-3-methylbutan-1-amine
PubChem CID80544103
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name4-(2-ethylmorpholin-4-yl)-3-methylbutan-1-amine
SMILESCCC1CN(CC(C)CCN)CCO1
InChIInChI=1S/C11H24N2O/c1-3-11-9-13(6-7-14-11)8-10(2)4-5-12/h10-11H,3-9,12H2,1-2H3
InChIKeyWTISXJMKGHYHNG-UHFFFAOYSA-N
XLogP1.08
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-1-(2-ethylmorpholin-4-yl)propan-2-amine
CID 103934483
5-(2-ethylmorpholin-4-yl)-2-methylpentan-1-amine
CID 82017099
3-(2-ethylmorpholin-4-yl)butan-1-amine
CID 60913991
2,4-diethylmorpholine
CID 58988021
methyl 3-(2-ethylmorpholin-4-yl)-2-methylpropanoate
CID 43562855
3-(2-ethylmorpholin-4-yl)-2-phenylpropan-1-amine
CID 43562330
[4-(2-ethylbutyl)morpholin-2-yl]methanamine
CID 82924060
methyl 2-acetamido-3-(2-ethylmorpholin-4-yl)propanoate
CID 65442042
3-(2-ethylmorpholin-4-yl)-2,2-dimethylpropan-1-amine
CID 62258556
2-(2-ethylmorpholin-4-yl)-1-(oxolan-3-yl)ethanamine
CID 104744806
3-[2-(aminomethyl)morpholin-4-yl]-2-methylpropanamide
CID 61336630
2-(2-ethyl-1,4-oxazepan-4-yl)ethanamine
CID 130485470

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethylmorpholin-4-yl)-3-methylbutan-1-amine?
The IUPAC name of 4-(2-ethylmorpholin-4-yl)-3-methylbutan-1-amine (CID 80544103) is 4-(2-ethylmorpholin-4-yl)-3-methylbutan-1-amine.
What is the SMILES notation for 4-(2-ethylmorpholin-4-yl)-3-methylbutan-1-amine?
The canonical SMILES for 4-(2-ethylmorpholin-4-yl)-3-methylbutan-1-amine is CCC1CN(CC(C)CCN)CCO1.
What is the InChIKey of 4-(2-ethylmorpholin-4-yl)-3-methylbutan-1-amine?
The InChIKey is WTISXJMKGHYHNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-3-11-9-13(6-7-14-11)8-10(2)4-5-12/h10-11H,3-9,12H2,1-2H3.
What are the key properties of 4-(2-ethylmorpholin-4-yl)-3-methylbutan-1-amine?
4-(2-ethylmorpholin-4-yl)-3-methylbutan-1-amine has a molecular weight of 200.33 g/mol, XLogP of 1.08, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethylmorpholin-4-yl)-3-methylbutan-1-amine is sourced from PubChem (CID 80544103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).