1-(2-fluorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine

C15H23FN2O — CID 112634306

IUPAC1-(2-fluorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine
SMILESCCC(NCC1CN(C)CCO1)c1ccccc1F
InChIInChI=1S/C15H23FN2O/c1-3-15(13-6-4-5-7-14(13)16)17-10-12-11-18(2)8-9-19-12/h4-7,12,15,17H,3,8-11H2,1-2H3
InChIKeyYWBUKSONFGKZNL-UHFFFAOYSA-N
MW266.36 g/mol
LogP2.20
Rot. Bonds5

About 1-(2-fluorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine

1-(2-fluorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine (PubChem CID 112634306) has the molecular formula C15H23FN2O and a molecular weight of 266.36 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine
PubChem CID112634306
Molecular FormulaC15H23FN2O
Molecular Weight266.36 g/mol
Exact Mass266.18
IUPAC Name1-(2-fluorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine
SMILESCCC(NCC1CN(C)CCO1)c1ccccc1F
InChIInChI=1S/C15H23FN2O/c1-3-15(13-6-4-5-7-14(13)16)17-10-12-11-18(2)8-9-19-12/h4-7,12,15,17H,3,8-11H2,1-2H3
InChIKeyYWBUKSONFGKZNL-UHFFFAOYSA-N
XLogP2.20
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.36
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxyphenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine
CID 79083025
(1S)-N-[[(2S)-4-methylmorpholin-2-yl]methyl]-1-phenylpropan-1-amine
CID 95291809
1-(4-fluorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine
CID 78997863
(1S)-1-(2-bromophenyl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine
CID 81383986
(1R)-1-(2-bromophenyl)-N-[(4-methylmorpholin-2-yl)methyl]ethanamine
CID 81383657
N-[(2-fluorophenyl)methyl]-1-[(2R)-4-methylmorpholin-2-yl]methanamine
CID 124542983
N-(cyclohexylmethyl)-1-(2-fluorophenyl)propan-1-amine
CID 112676916
1-[4-[1-(2-fluorophenyl)propyl]morpholin-2-yl]-N-methylmethanamine
CID 112679246
(1S)-1-(2,4-difluorophenyl)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]ethanamine
CID 95291844
N-[(4-methylmorpholin-2-yl)methyl]-1-(1,3-thiazol-2-yl)propan-1-amine
CID 79171502
N-[[(2S)-4-methylmorpholin-2-yl]methyl]propan-2-amine
CID 96645037
3-methyl-N-[(4-methylmorpholin-2-yl)methyl]pentan-2-amine
CID 75356168

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine?
The IUPAC name of 1-(2-fluorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine (CID 112634306) is 1-(2-fluorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine.
What is the SMILES notation for 1-(2-fluorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine?
The canonical SMILES for 1-(2-fluorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine is CCC(NCC1CN(C)CCO1)c1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine?
The InChIKey is YWBUKSONFGKZNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23FN2O/c1-3-15(13-6-4-5-7-14(13)16)17-10-12-11-18(2)8-9-19-12/h4-7,12,15,17H,3,8-11H2,1-2H3.
What are the key properties of 1-(2-fluorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine?
1-(2-fluorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine has a molecular weight of 266.36 g/mol, XLogP of 2.20, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine is sourced from PubChem (CID 112634306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).