(3-fluoro-5-pyrrolidin-1-ylphenyl)methanamine

C11H15FN2 — CID 102813283

IUPAC(3-fluoro-5-pyrrolidin-1-ylphenyl)methanamine
SMILESNCc1cc(F)cc(N2CCCC2)c1
InChIInChI=1S/C11H15FN2/c12-10-5-9(8-13)6-11(7-10)14-3-1-2-4-14/h5-7H,1-4,8,13H2
InChIKeyPMAZAEBHKUHHSC-UHFFFAOYSA-N
MW194.25 g/mol
LogP1.88
Rot. Bonds2

About (3-fluoro-5-pyrrolidin-1-ylphenyl)methanamine

(3-fluoro-5-pyrrolidin-1-ylphenyl)methanamine (PubChem CID 102813283) has the molecular formula C11H15FN2 and a molecular weight of 194.25 g/mol. Its IUPAC name is (3-fluoro-5-pyrrolidin-1-ylphenyl)methanamine.

Molecular Properties

Compound Name(3-fluoro-5-pyrrolidin-1-ylphenyl)methanamine
PubChem CID102813283
Molecular FormulaC11H15FN2
Molecular Weight194.25 g/mol
Exact Mass194.12
IUPAC Name(3-fluoro-5-pyrrolidin-1-ylphenyl)methanamine
SMILESNCc1cc(F)cc(N2CCCC2)c1
InChIInChI=1S/C11H15FN2/c12-10-5-9(8-13)6-11(7-10)14-3-1-2-4-14/h5-7H,1-4,8,13H2
InChIKeyPMAZAEBHKUHHSC-UHFFFAOYSA-N
XLogP1.88
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.25
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (3-fluoro-5-pyrrolidin-1-ylphenyl)methanamine 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-[3-(aminomethyl)-5-fluorophenyl]-1,4-diazepan-1-yl]ethanone
CID 102813773
1-[3-(aminomethyl)-5-fluorophenyl]piperidine-4-carboxamide
CID 102813342
1-[3-(chloromethyl)-5-fluorophenyl]azocane
CID 106530289
1-(3,5-difluorophenyl)pyrrolidine
CID 18454792
1-[4-[3-(aminomethyl)-5-fluorophenyl]piperazin-1-yl]ethanone
CID 102813334
[3-fluoro-5-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]methanamine
CID 102813357
1-(3,5-difluorophenyl)piperidine
CID 55251038
[3-(3,3-dimethylpyrrolidin-1-yl)-5-fluorophenyl]methanamine
CID 102814167
4-[3-(aminomethyl)-5-fluorophenyl]piperazin-2-one
CID 102813310
[3-(4-tert-butyl-3,6-dihydro-2H-pyridin-1-yl)-5-fluorophenyl]methanamine
CID 102814339
2-[3-(4,4-dimethylazepan-1-yl)-5-fluorophenyl]ethanamine
CID 106532861
methyl 3-(aminomethyl)-5-pyrrolidin-1-ylbenzoate
CID 118394765

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-5-pyrrolidin-1-ylphenyl)methanamine?
The IUPAC name of (3-fluoro-5-pyrrolidin-1-ylphenyl)methanamine (CID 102813283) is (3-fluoro-5-pyrrolidin-1-ylphenyl)methanamine.
What is the SMILES notation for (3-fluoro-5-pyrrolidin-1-ylphenyl)methanamine?
The canonical SMILES for (3-fluoro-5-pyrrolidin-1-ylphenyl)methanamine is NCc1cc(F)cc(N2CCCC2)c1.
What is the InChIKey of (3-fluoro-5-pyrrolidin-1-ylphenyl)methanamine?
The InChIKey is PMAZAEBHKUHHSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2/c12-10-5-9(8-13)6-11(7-10)14-3-1-2-4-14/h5-7H,1-4,8,13H2.
What are the key properties of (3-fluoro-5-pyrrolidin-1-ylphenyl)methanamine?
(3-fluoro-5-pyrrolidin-1-ylphenyl)methanamine has a molecular weight of 194.25 g/mol, XLogP of 1.88, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-5-pyrrolidin-1-ylphenyl)methanamine is sourced from PubChem (CID 102813283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).