1-(2-morpholin-4-ylphenyl)-N-propylpropan-1-amine

C16H26N2O — CID 112677731

IUPAC1-(2-morpholin-4-ylphenyl)-N-propylpropan-1-amine
SMILESCCCNC(CC)c1ccccc1N1CCOCC1
InChIInChI=1S/C16H26N2O/c1-3-9-17-15(4-2)14-7-5-6-8-16(14)18-10-12-19-13-11-18/h5-8,15,17H,3-4,9-13H2,1-2H3
InChIKeyAKWOOFURCLIZHE-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.97
Rot. Bonds6

About 1-(2-morpholin-4-ylphenyl)-N-propylpropan-1-amine

1-(2-morpholin-4-ylphenyl)-N-propylpropan-1-amine (PubChem CID 112677731) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 1-(2-morpholin-4-ylphenyl)-N-propylpropan-1-amine.

Molecular Properties

Compound Name1-(2-morpholin-4-ylphenyl)-N-propylpropan-1-amine
PubChem CID112677731
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name1-(2-morpholin-4-ylphenyl)-N-propylpropan-1-amine
SMILESCCCNC(CC)c1ccccc1N1CCOCC1
InChIInChI=1S/C16H26N2O/c1-3-9-17-15(4-2)14-7-5-6-8-16(14)18-10-12-19-13-11-18/h5-8,15,17H,3-4,9-13H2,1-2H3
InChIKeyAKWOOFURCLIZHE-UHFFFAOYSA-N
XLogP2.97
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(azepan-1-yl)phenyl]-N-propylpropan-1-amine
CID 115994785
1-[2-(4-methyl-1,4-diazepan-1-yl)phenyl]-N-propylpropan-1-amine
CID 115994832
1-[2-(3-methylpyrrolidin-1-yl)phenyl]-N-propylpropan-1-amine
CID 112677950
1-[2-(azepan-1-yl)phenyl]-N-ethylpropan-1-amine
CID 112677754
N-ethyl-1-[2-(4-methylpiperidin-1-yl)phenyl]propan-1-amine
CID 112677727
1-[2-(2,4-dimethylpiperidin-1-yl)phenyl]-N-propylpropan-1-amine
CID 115995156
1-[2-(2-propan-2-ylpyrrolidin-1-yl)phenyl]-N-propylpropan-1-amine
CID 115995308
N-[1-[2-(azepan-1-yl)phenyl]ethyl]propan-1-amine
CID 43284031
ethoxy-(2-morpholin-4-ylphenyl)methanol
CID 91211184
N-[1-(2-piperidin-1-ylphenyl)ethyl]propan-1-amine
CID 43284321
(1R)-1-(2-morpholin-4-ylphenyl)ethanol
CID 78939110
1-[2-(4-methylpyrazol-1-yl)phenyl]-N-propylpropan-1-amine
CID 112678315

Frequently Asked Questions

What is the IUPAC name of 1-(2-morpholin-4-ylphenyl)-N-propylpropan-1-amine?
The IUPAC name of 1-(2-morpholin-4-ylphenyl)-N-propylpropan-1-amine (CID 112677731) is 1-(2-morpholin-4-ylphenyl)-N-propylpropan-1-amine.
What is the SMILES notation for 1-(2-morpholin-4-ylphenyl)-N-propylpropan-1-amine?
The canonical SMILES for 1-(2-morpholin-4-ylphenyl)-N-propylpropan-1-amine is CCCNC(CC)c1ccccc1N1CCOCC1.
What is the InChIKey of 1-(2-morpholin-4-ylphenyl)-N-propylpropan-1-amine?
The InChIKey is AKWOOFURCLIZHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-3-9-17-15(4-2)14-7-5-6-8-16(14)18-10-12-19-13-11-18/h5-8,15,17H,3-4,9-13H2,1-2H3.
What are the key properties of 1-(2-morpholin-4-ylphenyl)-N-propylpropan-1-amine?
1-(2-morpholin-4-ylphenyl)-N-propylpropan-1-amine has a molecular weight of 262.40 g/mol, XLogP of 2.97, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-morpholin-4-ylphenyl)-N-propylpropan-1-amine is sourced from PubChem (CID 112677731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).