1-(2,2-dimethylmorpholin-4-yl)-3,3-dimethylbutan-2-amine

C12H26N2O — CID 43592748

IUPAC1-(2,2-dimethylmorpholin-4-yl)-3,3-dimethylbutan-2-amine
SMILESCC1(C)CN(CC(N)C(C)(C)C)CCO1
InChIInChI=1S/C12H26N2O/c1-11(2,3)10(13)8-14-6-7-15-12(4,5)9-14/h10H,6-9,13H2,1-5H3
InChIKeyMTXIFWUJVJUERT-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.47
Rot. Bonds2

About 1-(2,2-dimethylmorpholin-4-yl)-3,3-dimethylbutan-2-amine

1-(2,2-dimethylmorpholin-4-yl)-3,3-dimethylbutan-2-amine (PubChem CID 43592748) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 1-(2,2-dimethylmorpholin-4-yl)-3,3-dimethylbutan-2-amine.

Molecular Properties

Compound Name1-(2,2-dimethylmorpholin-4-yl)-3,3-dimethylbutan-2-amine
PubChem CID43592748
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name1-(2,2-dimethylmorpholin-4-yl)-3,3-dimethylbutan-2-amine
SMILESCC1(C)CN(CC(N)C(C)(C)C)CCO1
InChIInChI=1S/C12H26N2O/c1-11(2,3)10(13)8-14-6-7-15-12(4,5)9-14/h10H,6-9,13H2,1-5H3
InChIKeyMTXIFWUJVJUERT-UHFFFAOYSA-N
XLogP1.47
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2,2-dimethylmorpholin-4-yl)-2,3,3-trimethylbutan-2-amine
CID 65267178
1-(2,2-dimethylmorpholin-4-yl)-3-phenylpropan-2-amine
CID 43592951
2-(2,2-dimethylmorpholin-4-yl)-1-(1-methylpyrazol-4-yl)ethanamine
CID 115291150
4-(2,2-dimethylmorpholin-4-yl)butan-1-amine
CID 43592480
1-[(2,2-dimethylmorpholin-4-yl)methyl]cyclopropan-1-amine
CID 65459106
2-(2,2-dimethylmorpholin-4-yl)-1-naphthalen-2-ylethanamine
CID 43592754
(2S)-2-amino-1-(2,2-dimethylmorpholin-4-yl)-3,3-dimethylbutan-1-one
CID 61153898
N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-3-methylbutan-2-amine
CID 62559338
2,2-dimethyl-4-prop-2-enylmorpholine
CID 70009484
1-(2-aminophenyl)-2-(2,2-dimethylmorpholin-4-yl)ethanol
CID 62265085
2-amino-6-(2,2-dimethylmorpholin-4-yl)-2-methylhexan-1-ol
CID 64798764
2-(2,2-dimethylmorpholin-4-yl)-1-(oxolan-3-yl)ethanol
CID 104752564

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylmorpholin-4-yl)-3,3-dimethylbutan-2-amine?
The IUPAC name of 1-(2,2-dimethylmorpholin-4-yl)-3,3-dimethylbutan-2-amine (CID 43592748) is 1-(2,2-dimethylmorpholin-4-yl)-3,3-dimethylbutan-2-amine.
What is the SMILES notation for 1-(2,2-dimethylmorpholin-4-yl)-3,3-dimethylbutan-2-amine?
The canonical SMILES for 1-(2,2-dimethylmorpholin-4-yl)-3,3-dimethylbutan-2-amine is CC1(C)CN(CC(N)C(C)(C)C)CCO1.
What is the InChIKey of 1-(2,2-dimethylmorpholin-4-yl)-3,3-dimethylbutan-2-amine?
The InChIKey is MTXIFWUJVJUERT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-11(2,3)10(13)8-14-6-7-15-12(4,5)9-14/h10H,6-9,13H2,1-5H3.
What are the key properties of 1-(2,2-dimethylmorpholin-4-yl)-3,3-dimethylbutan-2-amine?
1-(2,2-dimethylmorpholin-4-yl)-3,3-dimethylbutan-2-amine has a molecular weight of 214.35 g/mol, XLogP of 1.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylmorpholin-4-yl)-3,3-dimethylbutan-2-amine is sourced from PubChem (CID 43592748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).