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

C9H20N2O — CID 25219383

IUPAC2,2-dimethyl-3-morpholin-4-ylpropan-1-amine
SMILESCC(C)(CN)CN1CCOCC1
InChIInChI=1S/C9H20N2O/c1-9(2,7-10)8-11-3-5-12-6-4-11/h3-8,10H2,1-2H3
InChIKeyCQMVORYYVMMMSP-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.30
Rot. Bonds3

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

2,2-dimethyl-3-morpholin-4-ylpropan-1-amine (PubChem CID 25219383) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is 2,2-dimethyl-3-morpholin-4-ylpropan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-3-morpholin-4-ylpropan-1-amine
PubChem CID25219383
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name2,2-dimethyl-3-morpholin-4-ylpropan-1-amine
SMILESCC(C)(CN)CN1CCOCC1
InChIInChI=1S/C9H20N2O/c1-9(2,7-10)8-11-3-5-12-6-4-11/h3-8,10H2,1-2H3
InChIKeyCQMVORYYVMMMSP-UHFFFAOYSA-N
XLogP0.30
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3-morpholin-4-ylpropan-1-amine?
The IUPAC name of 2,2-dimethyl-3-morpholin-4-ylpropan-1-amine (CID 25219383) is 2,2-dimethyl-3-morpholin-4-ylpropan-1-amine.
What is the SMILES notation for 2,2-dimethyl-3-morpholin-4-ylpropan-1-amine?
The canonical SMILES for 2,2-dimethyl-3-morpholin-4-ylpropan-1-amine is CC(C)(CN)CN1CCOCC1.
What is the InChIKey of 2,2-dimethyl-3-morpholin-4-ylpropan-1-amine?
The InChIKey is CQMVORYYVMMMSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-9(2,7-10)8-11-3-5-12-6-4-11/h3-8,10H2,1-2H3.
What are the key properties of 2,2-dimethyl-3-morpholin-4-ylpropan-1-amine?
2,2-dimethyl-3-morpholin-4-ylpropan-1-amine has a molecular weight of 172.27 g/mol, XLogP of 0.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3-morpholin-4-ylpropan-1-amine is sourced from PubChem (CID 25219383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).