1-(4-morpholin-4-ylphenyl)propan-1-amine

C13H20N2O — CID 103693302

IUPAC1-(4-morpholin-4-ylphenyl)propan-1-amine
SMILESCCC(N)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C13H20N2O/c1-2-13(14)11-3-5-12(6-4-11)15-7-9-16-10-8-15/h3-6,13H,2,7-10,14H2,1H3
InChIKeyIYTYENYXEPQHPF-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.93
Rot. Bonds3

About 1-(4-morpholin-4-ylphenyl)propan-1-amine

1-(4-morpholin-4-ylphenyl)propan-1-amine (PubChem CID 103693302) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 1-(4-morpholin-4-ylphenyl)propan-1-amine.

Molecular Properties

Compound Name1-(4-morpholin-4-ylphenyl)propan-1-amine
PubChem CID103693302
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name1-(4-morpholin-4-ylphenyl)propan-1-amine
SMILESCCC(N)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C13H20N2O/c1-2-13(14)11-3-5-12(6-4-11)15-7-9-16-10-8-15/h3-6,13H,2,7-10,14H2,1H3
InChIKeyIYTYENYXEPQHPF-UHFFFAOYSA-N
XLogP1.93
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

(1R)-1-(4-piperidin-1-ylphenyl)propan-1-amine
CID 103694418
(1R)-1-[4-(4-methylpiperazin-1-yl)phenyl]propan-1-amine
CID 113242060
2-amino-2-(4-morpholin-4-ylphenyl)ethanethiol
CID 87683185
(1S)-2-methyl-1-(4-morpholin-4-ylphenyl)propan-1-amine
CID 124563582
(1R)-1-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]propan-1-amine
CID 114066341
(1S)-1-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]propan-1-amine
CID 114066342
1-[4-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)phenyl]propan-1-amine
CID 114066337
1-[4-(3,5-dimethylpiperidin-1-yl)phenyl]propan-1-amine
CID 114065989
4-(4-ethylphenyl)morpholine
CID 20576442
2-[4-[(1S)-1-aminopropyl]phenoxy]-1-morpholin-4-ylpropan-1-one
CID 63367920
4-(4-morpholin-4-ylphenyl)butan-2-amine
CID 23009589
1-[4-[[4-[(4-pyrrolidin-1-ylphenyl)diazenyl]phenyl]diazenyl]phenyl]butan-1-amine
CID 167106796

Frequently Asked Questions

What is the IUPAC name of 1-(4-morpholin-4-ylphenyl)propan-1-amine?
The IUPAC name of 1-(4-morpholin-4-ylphenyl)propan-1-amine (CID 103693302) is 1-(4-morpholin-4-ylphenyl)propan-1-amine.
What is the SMILES notation for 1-(4-morpholin-4-ylphenyl)propan-1-amine?
The canonical SMILES for 1-(4-morpholin-4-ylphenyl)propan-1-amine is CCC(N)c1ccc(N2CCOCC2)cc1.
What is the InChIKey of 1-(4-morpholin-4-ylphenyl)propan-1-amine?
The InChIKey is IYTYENYXEPQHPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-2-13(14)11-3-5-12(6-4-11)15-7-9-16-10-8-15/h3-6,13H,2,7-10,14H2,1H3.
What are the key properties of 1-(4-morpholin-4-ylphenyl)propan-1-amine?
1-(4-morpholin-4-ylphenyl)propan-1-amine has a molecular weight of 220.32 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-morpholin-4-ylphenyl)propan-1-amine is sourced from PubChem (CID 103693302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).