3,3-dimethyl-1-morpholin-4-ylbutan-2-amine

C10H22N2O — CID 16788911

IUPAC3,3-dimethyl-1-morpholin-4-ylbutan-2-amine
SMILESCC(C)(C)C(N)CN1CCOCC1
InChIInChI=1S/C10H22N2O/c1-10(2,3)9(11)8-12-4-6-13-7-5-12/h9H,4-8,11H2,1-3H3
InChIKeyDKPDLTGDTFHZCE-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.69
Rot. Bonds2

About 3,3-dimethyl-1-morpholin-4-ylbutan-2-amine

3,3-dimethyl-1-morpholin-4-ylbutan-2-amine (PubChem CID 16788911) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 3,3-dimethyl-1-morpholin-4-ylbutan-2-amine.

Molecular Properties

Compound Name3,3-dimethyl-1-morpholin-4-ylbutan-2-amine
PubChem CID16788911
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name3,3-dimethyl-1-morpholin-4-ylbutan-2-amine
SMILESCC(C)(C)C(N)CN1CCOCC1
InChIInChI=1S/C10H22N2O/c1-10(2,3)9(11)8-12-4-6-13-7-5-12/h9H,4-8,11H2,1-3H3
InChIKeyDKPDLTGDTFHZCE-UHFFFAOYSA-N
XLogP0.69
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-1-morpholin-4-ylbutan-2-amine?
The IUPAC name of 3,3-dimethyl-1-morpholin-4-ylbutan-2-amine (CID 16788911) is 3,3-dimethyl-1-morpholin-4-ylbutan-2-amine.
What is the SMILES notation for 3,3-dimethyl-1-morpholin-4-ylbutan-2-amine?
The canonical SMILES for 3,3-dimethyl-1-morpholin-4-ylbutan-2-amine is CC(C)(C)C(N)CN1CCOCC1.
What is the InChIKey of 3,3-dimethyl-1-morpholin-4-ylbutan-2-amine?
The InChIKey is DKPDLTGDTFHZCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-10(2,3)9(11)8-12-4-6-13-7-5-12/h9H,4-8,11H2,1-3H3.
What are the key properties of 3,3-dimethyl-1-morpholin-4-ylbutan-2-amine?
3,3-dimethyl-1-morpholin-4-ylbutan-2-amine has a molecular weight of 186.30 g/mol, XLogP of 0.69, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-1-morpholin-4-ylbutan-2-amine is sourced from PubChem (CID 16788911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).