1-(2-fluorophenyl)-3-(3-methoxypyrrolidin-1-yl)-N-methylpropan-1-amine

C15H23FN2O — CID 103538884

IUPAC1-(2-fluorophenyl)-3-(3-methoxypyrrolidin-1-yl)-N-methylpropan-1-amine
SMILESCNC(CCN1CCC(OC)C1)c1ccccc1F
InChIInChI=1S/C15H23FN2O/c1-17-15(13-5-3-4-6-14(13)16)8-10-18-9-7-12(11-18)19-2/h3-6,12,15,17H,7-11H2,1-2H3
InChIKeyRLCOZNMROOEOAX-UHFFFAOYSA-N
MW266.36 g/mol
LogP2.20
Rot. Bonds6

About 1-(2-fluorophenyl)-3-(3-methoxypyrrolidin-1-yl)-N-methylpropan-1-amine

1-(2-fluorophenyl)-3-(3-methoxypyrrolidin-1-yl)-N-methylpropan-1-amine (PubChem CID 103538884) has the molecular formula C15H23FN2O and a molecular weight of 266.36 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-3-(3-methoxypyrrolidin-1-yl)-N-methylpropan-1-amine.

Molecular Properties

Compound Name1-(2-fluorophenyl)-3-(3-methoxypyrrolidin-1-yl)-N-methylpropan-1-amine
PubChem CID103538884
Molecular FormulaC15H23FN2O
Molecular Weight266.36 g/mol
Exact Mass266.18
IUPAC Name1-(2-fluorophenyl)-3-(3-methoxypyrrolidin-1-yl)-N-methylpropan-1-amine
SMILESCNC(CCN1CCC(OC)C1)c1ccccc1F
InChIInChI=1S/C15H23FN2O/c1-17-15(13-5-3-4-6-14(13)16)8-10-18-9-7-12(11-18)19-2/h3-6,12,15,17H,7-11H2,1-2H3
InChIKeyRLCOZNMROOEOAX-UHFFFAOYSA-N
XLogP2.20
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
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

3-(azepan-1-yl)-1-(2-fluorophenyl)-N-methylpropan-1-amine
CID 62644958
1-(5-fluoro-2-pyridinyl)-3-(3-methoxypyrrolidin-1-yl)-N-methylpropan-1-amine
CID 103539032
1-(2-fluorophenyl)-3-(3-methoxypiperidin-1-yl)-N,2-dimethylpropan-1-amine
CID 102967344
2-[(3S)-3-methoxypyrrolidin-1-yl]-N-methyl-1-phenylethanamine
CID 135374431
1-(2-ethoxyphenyl)-2-(3-methoxypyrrolidin-1-yl)-N-methylethanamine
CID 103532336
3-(3-methoxypyrrolidin-1-yl)-1-(2-methylphenyl)propan-1-amine
CID 103538996
3-(4-ethoxypiperidin-1-yl)-N-methyl-1-(2-methylphenyl)propan-1-amine
CID 62630611
1-(2-fluorophenyl)-N-methyl-3-(3-methylmorpholin-4-yl)propan-1-amine
CID 62644652
1-(3-bromophenyl)-3-(3-methoxypiperidin-1-yl)-N-methylpropan-1-amine
CID 102967425
1-(3-bromophenyl)-3-(4-methoxypiperidin-1-yl)-N-methylpropan-1-amine
CID 62618049
2-(3-methoxypyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine
CID 103532164
N-[2-(3-methoxypyrrolidin-1-yl)ethyl]-2-methylaniline
CID 103540070

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-3-(3-methoxypyrrolidin-1-yl)-N-methylpropan-1-amine?
The IUPAC name of 1-(2-fluorophenyl)-3-(3-methoxypyrrolidin-1-yl)-N-methylpropan-1-amine (CID 103538884) is 1-(2-fluorophenyl)-3-(3-methoxypyrrolidin-1-yl)-N-methylpropan-1-amine.
What is the SMILES notation for 1-(2-fluorophenyl)-3-(3-methoxypyrrolidin-1-yl)-N-methylpropan-1-amine?
The canonical SMILES for 1-(2-fluorophenyl)-3-(3-methoxypyrrolidin-1-yl)-N-methylpropan-1-amine is CNC(CCN1CCC(OC)C1)c1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)-3-(3-methoxypyrrolidin-1-yl)-N-methylpropan-1-amine?
The InChIKey is RLCOZNMROOEOAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23FN2O/c1-17-15(13-5-3-4-6-14(13)16)8-10-18-9-7-12(11-18)19-2/h3-6,12,15,17H,7-11H2,1-2H3.
What are the key properties of 1-(2-fluorophenyl)-3-(3-methoxypyrrolidin-1-yl)-N-methylpropan-1-amine?
1-(2-fluorophenyl)-3-(3-methoxypyrrolidin-1-yl)-N-methylpropan-1-amine has a molecular weight of 266.36 g/mol, XLogP of 2.20, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-3-(3-methoxypyrrolidin-1-yl)-N-methylpropan-1-amine is sourced from PubChem (CID 103538884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).