1-[2-(2-fluorophenyl)ethyl]-N-propylpyrrolidin-3-amine

C15H23FN2 — CID 43315228

IUPAC1-[2-(2-fluorophenyl)ethyl]-N-propylpyrrolidin-3-amine
SMILESCCCNC1CCN(CCc2ccccc2F)C1
InChIInChI=1S/C15H23FN2/c1-2-9-17-14-8-11-18(12-14)10-7-13-5-3-4-6-15(13)16/h3-6,14,17H,2,7-12H2,1H3
InChIKeyRXQOULMLTWLPKN-UHFFFAOYSA-N
MW250.36 g/mol
LogP2.44
Rot. Bonds6

About 1-[2-(2-fluorophenyl)ethyl]-N-propylpyrrolidin-3-amine

1-[2-(2-fluorophenyl)ethyl]-N-propylpyrrolidin-3-amine (PubChem CID 43315228) has the molecular formula C15H23FN2 and a molecular weight of 250.36 g/mol. Its IUPAC name is 1-[2-(2-fluorophenyl)ethyl]-N-propylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-[2-(2-fluorophenyl)ethyl]-N-propylpyrrolidin-3-amine
PubChem CID43315228
Molecular FormulaC15H23FN2
Molecular Weight250.36 g/mol
Exact Mass250.18
IUPAC Name1-[2-(2-fluorophenyl)ethyl]-N-propylpyrrolidin-3-amine
SMILESCCCNC1CCN(CCc2ccccc2F)C1
InChIInChI=1S/C15H23FN2/c1-2-9-17-14-8-11-18(12-14)10-7-13-5-3-4-6-15(13)16/h3-6,14,17H,2,7-12H2,1H3
InChIKeyRXQOULMLTWLPKN-UHFFFAOYSA-N
XLogP2.44
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-propyl-1-(2-quinolin-8-ylethyl)pyrrolidin-3-amine
CID 81428007
N-[2-(2-fluorophenyl)ethyl]-1-(2-methylpropyl)piperidin-4-amine
CID 103776045
1-(3-phenoxypropyl)-N-propylpyrrolidin-3-amine
CID 55068553
1-(2,6-difluorophenyl)-N-propylpyrrolidin-3-amine
CID 43315556
8-[(2-fluorophenyl)methyl]-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 62739080
1-[2-(3-fluorophenyl)ethyl]-N-propylpiperidin-4-amine
CID 43566257
1-[2-(5-bromothiophen-2-yl)ethyl]-N-propylpyrrolidin-3-amine
CID 114139701
1-(3-methylbutyl)-N-propylpyrrolidin-3-amine
CID 43314968
N-propyl-1-(pyridin-2-ylmethyl)pyrrolidin-3-amine
CID 60860967
1-[2-(3,4-dimethoxyphenyl)ethyl]-N-propylpyrrolidin-3-amine
CID 43315157
2-[1-[2-(2-fluorophenyl)ethyl]piperidin-4-yl]ethanamine
CID 95461564
1-(naphthalen-1-ylmethyl)-N-propylpiperidin-4-amine
CID 60820486

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-fluorophenyl)ethyl]-N-propylpyrrolidin-3-amine?
The IUPAC name of 1-[2-(2-fluorophenyl)ethyl]-N-propylpyrrolidin-3-amine (CID 43315228) is 1-[2-(2-fluorophenyl)ethyl]-N-propylpyrrolidin-3-amine.
What is the SMILES notation for 1-[2-(2-fluorophenyl)ethyl]-N-propylpyrrolidin-3-amine?
The canonical SMILES for 1-[2-(2-fluorophenyl)ethyl]-N-propylpyrrolidin-3-amine is CCCNC1CCN(CCc2ccccc2F)C1.
What is the InChIKey of 1-[2-(2-fluorophenyl)ethyl]-N-propylpyrrolidin-3-amine?
The InChIKey is RXQOULMLTWLPKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23FN2/c1-2-9-17-14-8-11-18(12-14)10-7-13-5-3-4-6-15(13)16/h3-6,14,17H,2,7-12H2,1H3.
What are the key properties of 1-[2-(2-fluorophenyl)ethyl]-N-propylpyrrolidin-3-amine?
1-[2-(2-fluorophenyl)ethyl]-N-propylpyrrolidin-3-amine has a molecular weight of 250.36 g/mol, XLogP of 2.44, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-fluorophenyl)ethyl]-N-propylpyrrolidin-3-amine is sourced from PubChem (CID 43315228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).