1-(4-fluorophenyl)-2-pyrrolidin-2-ylethanamine

C12H17FN2 — CID 116935942

IUPAC1-(4-fluorophenyl)-2-pyrrolidin-2-ylethanamine
SMILESNC(CC1CCCN1)c1ccc(F)cc1
InChIInChI=1S/C12H17FN2/c13-10-5-3-9(4-6-10)12(14)8-11-2-1-7-15-11/h3-6,11-12,15H,1-2,7-8,14H2
InChIKeyFWYMKORKWFODLX-UHFFFAOYSA-N
MW208.28 g/mol
LogP1.97
Rot. Bonds3

About 1-(4-fluorophenyl)-2-pyrrolidin-2-ylethanamine

1-(4-fluorophenyl)-2-pyrrolidin-2-ylethanamine (PubChem CID 116935942) has the molecular formula C12H17FN2 and a molecular weight of 208.28 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-pyrrolidin-2-ylethanamine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2-pyrrolidin-2-ylethanamine
PubChem CID116935942
Molecular FormulaC12H17FN2
Molecular Weight208.28 g/mol
Exact Mass208.14
IUPAC Name1-(4-fluorophenyl)-2-pyrrolidin-2-ylethanamine
SMILESNC(CC1CCCN1)c1ccc(F)cc1
InChIInChI=1S/C12H17FN2/c13-10-5-3-9(4-6-10)12(14)8-11-2-1-7-15-11/h3-6,11-12,15H,1-2,7-8,14H2
InChIKeyFWYMKORKWFODLX-UHFFFAOYSA-N
XLogP1.97
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.28
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(4-fluorophenyl)-2-pyrrolidin-2-ylethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-methylsulfanylphenyl)-2-piperidin-2-ylethanamine
CID 116936276
2-pyrrolidin-2-yl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
CID 116935941
1-(4-fluorophenyl)-2-piperidin-2-ylethanol
CID 79559666
1-(6-methylnaphthalen-2-yl)-2-pyrrolidin-2-ylethanamine
CID 116936059
1-(3-bromophenyl)-2-pyrrolidin-2-ylethanamine
CID 116936043
(1R)-2-cyclopropyl-1-(4-fluorophenyl)ethanamine
CID 94248777
1-(2,3-dihydro-1-benzofuran-5-yl)-2-pyrrolidin-2-ylethanamine
CID 116936032
2-pyrrolidin-2-yl-1-thiophen-2-ylethanamine
CID 116935934
2-cyclopropyl-1-(4-fluorophenyl)ethanamine;hydrochloride
CID 131637709
1-(4-aminophenyl)-2-pyrrolidin-2-ylethanol
CID 84674533
N-[(1S)-1-(4-fluorophenyl)ethyl]-1-piperidin-2-ylpropan-2-amine
CID 81348101
6-(1-amino-2-pyrrolidin-2-ylethyl)-3-methyl-1,3-benzoxazol-2-one
CID 116936028

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2-pyrrolidin-2-ylethanamine?
The IUPAC name of 1-(4-fluorophenyl)-2-pyrrolidin-2-ylethanamine (CID 116935942) is 1-(4-fluorophenyl)-2-pyrrolidin-2-ylethanamine.
What is the SMILES notation for 1-(4-fluorophenyl)-2-pyrrolidin-2-ylethanamine?
The canonical SMILES for 1-(4-fluorophenyl)-2-pyrrolidin-2-ylethanamine is NC(CC1CCCN1)c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-2-pyrrolidin-2-ylethanamine?
The InChIKey is FWYMKORKWFODLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2/c13-10-5-3-9(4-6-10)12(14)8-11-2-1-7-15-11/h3-6,11-12,15H,1-2,7-8,14H2.
What are the key properties of 1-(4-fluorophenyl)-2-pyrrolidin-2-ylethanamine?
1-(4-fluorophenyl)-2-pyrrolidin-2-ylethanamine has a molecular weight of 208.28 g/mol, XLogP of 1.97, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-pyrrolidin-2-ylethanamine is sourced from PubChem (CID 116935942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).