1-morpholin-2-yl-N,N-dipropylpropan-1-amine

C13H28N2O — CID 20504825

IUPAC1-morpholin-2-yl-N,N-dipropylpropan-1-amine
SMILESCCCN(CCC)C(CC)C1CNCCO1
InChIInChI=1S/C13H28N2O/c1-4-8-15(9-5-2)12(6-3)13-11-14-7-10-16-13/h12-14H,4-11H2,1-3H3
InChIKeyDTEHIJBOGKFGCW-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.88
Rot. Bonds7

About 1-morpholin-2-yl-N,N-dipropylpropan-1-amine

1-morpholin-2-yl-N,N-dipropylpropan-1-amine (PubChem CID 20504825) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is 1-morpholin-2-yl-N,N-dipropylpropan-1-amine.

Molecular Properties

Compound Name1-morpholin-2-yl-N,N-dipropylpropan-1-amine
PubChem CID20504825
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name1-morpholin-2-yl-N,N-dipropylpropan-1-amine
SMILESCCCN(CCC)C(CC)C1CNCCO1
InChIInChI=1S/C13H28N2O/c1-4-8-15(9-5-2)12(6-3)13-11-14-7-10-16-13/h12-14H,4-11H2,1-3H3
InChIKeyDTEHIJBOGKFGCW-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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Frequently Asked Questions

What is the IUPAC name of 1-morpholin-2-yl-N,N-dipropylpropan-1-amine?
The IUPAC name of 1-morpholin-2-yl-N,N-dipropylpropan-1-amine (CID 20504825) is 1-morpholin-2-yl-N,N-dipropylpropan-1-amine.
What is the SMILES notation for 1-morpholin-2-yl-N,N-dipropylpropan-1-amine?
The canonical SMILES for 1-morpholin-2-yl-N,N-dipropylpropan-1-amine is CCCN(CCC)C(CC)C1CNCCO1.
What is the InChIKey of 1-morpholin-2-yl-N,N-dipropylpropan-1-amine?
The InChIKey is DTEHIJBOGKFGCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-4-8-15(9-5-2)12(6-3)13-11-14-7-10-16-13/h12-14H,4-11H2,1-3H3.
What are the key properties of 1-morpholin-2-yl-N,N-dipropylpropan-1-amine?
1-morpholin-2-yl-N,N-dipropylpropan-1-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 1-morpholin-2-yl-N,N-dipropylpropan-1-amine is sourced from PubChem (CID 20504825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).