1-(4-fluorophenyl)-3-morpholin-4-yl-N-propylpropan-1-amine

C16H25FN2O — CID 62643389

IUPAC1-(4-fluorophenyl)-3-morpholin-4-yl-N-propylpropan-1-amine
SMILESCCCNC(CCN1CCOCC1)c1ccc(F)cc1
InChIInChI=1S/C16H25FN2O/c1-2-8-18-16(14-3-5-15(17)6-4-14)7-9-19-10-12-20-13-11-19/h3-6,16,18H,2,7-13H2,1H3
InChIKeyNMUGXLDMAJTUAG-UHFFFAOYSA-N
MW280.39 g/mol
LogP2.59
Rot. Bonds7

About 1-(4-fluorophenyl)-3-morpholin-4-yl-N-propylpropan-1-amine

1-(4-fluorophenyl)-3-morpholin-4-yl-N-propylpropan-1-amine (PubChem CID 62643389) has the molecular formula C16H25FN2O and a molecular weight of 280.39 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-3-morpholin-4-yl-N-propylpropan-1-amine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-3-morpholin-4-yl-N-propylpropan-1-amine
PubChem CID62643389
Molecular FormulaC16H25FN2O
Molecular Weight280.39 g/mol
Exact Mass280.20
IUPAC Name1-(4-fluorophenyl)-3-morpholin-4-yl-N-propylpropan-1-amine
SMILESCCCNC(CCN1CCOCC1)c1ccc(F)cc1
InChIInChI=1S/C16H25FN2O/c1-2-8-18-16(14-3-5-15(17)6-4-14)7-9-19-10-12-20-13-11-19/h3-6,16,18H,2,7-13H2,1H3
InChIKeyNMUGXLDMAJTUAG-UHFFFAOYSA-N
XLogP2.59
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.39
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-fluorophenyl)-3-(2-methylmorpholin-4-yl)-N-propylpropan-1-amine
CID 62643747
1-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)propan-1-amine
CID 43195499
1-(4-chlorophenyl)-3-(1,4-oxazepan-4-yl)-N-propylpropan-1-amine
CID 62972105
1-(4-fluorophenyl)-N-propylpropan-1-amine
CID 43185194
3-(4-ethylpiperazin-1-yl)-1-(4-fluorophenyl)-N-methylpropan-1-amine
CID 62645471
1-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)propan-1-amine
CID 43195497
N-[2-(1,4-dimethylpiperazin-2-yl)-1-(4-fluorophenyl)ethyl]propan-1-amine
CID 115415645
1-[3-(4-bromophenyl)-3-(propylamino)propyl]piperidin-4-ol
CID 62612332
N-ethyl-3-(3-ethylmorpholin-4-yl)-1-(4-fluorophenyl)propan-1-amine
CID 62645364
1-(4-fluorophenyl)-3-propoxy-N-propylpropan-1-amine
CID 105088079
1-(4-fluorophenyl)-4-morpholin-4-ylbutan-1-ol
CID 4132449
3-cyclopentyl-1-(4-fluorophenyl)-N-propylpropan-1-amine
CID 43494684

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-3-morpholin-4-yl-N-propylpropan-1-amine?
The IUPAC name of 1-(4-fluorophenyl)-3-morpholin-4-yl-N-propylpropan-1-amine (CID 62643389) is 1-(4-fluorophenyl)-3-morpholin-4-yl-N-propylpropan-1-amine.
What is the SMILES notation for 1-(4-fluorophenyl)-3-morpholin-4-yl-N-propylpropan-1-amine?
The canonical SMILES for 1-(4-fluorophenyl)-3-morpholin-4-yl-N-propylpropan-1-amine is CCCNC(CCN1CCOCC1)c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-3-morpholin-4-yl-N-propylpropan-1-amine?
The InChIKey is NMUGXLDMAJTUAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25FN2O/c1-2-8-18-16(14-3-5-15(17)6-4-14)7-9-19-10-12-20-13-11-19/h3-6,16,18H,2,7-13H2,1H3.
What are the key properties of 1-(4-fluorophenyl)-3-morpholin-4-yl-N-propylpropan-1-amine?
1-(4-fluorophenyl)-3-morpholin-4-yl-N-propylpropan-1-amine has a molecular weight of 280.39 g/mol, XLogP of 2.59, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-3-morpholin-4-yl-N-propylpropan-1-amine is sourced from PubChem (CID 62643389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).