1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)propan-2-amine

C8H15FN2 — CID 127007480

IUPAC1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)propan-2-amine
SMILESCC(N)CN1CCC=C(F)C1
InChIInChI=1S/C8H15FN2/c1-7(10)5-11-4-2-3-8(9)6-11/h3,7H,2,4-6,10H2,1H3
InChIKeyJAKMITZYNHPGNM-UHFFFAOYSA-N
MW158.22 g/mol
LogP0.89
Rot. Bonds2

About 1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)propan-2-amine

1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)propan-2-amine (PubChem CID 127007480) has the molecular formula C8H15FN2 and a molecular weight of 158.22 g/mol. Its IUPAC name is 1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)propan-2-amine.

Molecular Properties

Compound Name1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)propan-2-amine
PubChem CID127007480
Molecular FormulaC8H15FN2
Molecular Weight158.22 g/mol
Exact Mass158.12
IUPAC Name1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)propan-2-amine
SMILESCC(N)CN1CCC=C(F)C1
InChIInChI=1S/C8H15FN2/c1-7(10)5-11-4-2-3-8(9)6-11/h3,7H,2,4-6,10H2,1H3
InChIKeyJAKMITZYNHPGNM-UHFFFAOYSA-N
XLogP0.89
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.22
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(azetidin-3-yl)propyl]-5-fluoro-3,6-dihydro-2H-pyridine
CID 131052436
3-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-2-methylpropanoic acid
CID 127007451
(2S)-1-(4,5-dimethyl-3,6-dihydro-2H-pyridin-1-yl)propan-2-amine
CID 131140813
5-bromo-1-(2,2-difluoroethyl)-3,6-dihydro-2H-pyridine
CID 126994945
4-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)butan-2-amine
CID 106315085
(2S)-1-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]propan-2-amine
CID 130523166
1-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]propan-2-amine
CID 114490242
4-[(2R)-2-aminopropyl]piperazin-2-one
CID 69001797
(2R)-1-(6-azaspiro[2.5]octan-6-yl)propan-2-amine
CID 122669555
3-chloro-6-[(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methyl]pyridazine
CID 126830546
1-(5-azaspiro[2.4]heptan-5-yl)propan-2-amine
CID 122669550
(2R)-1-(5-azaspiro[2.4]heptan-5-yl)propan-2-amine
CID 122669538

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)propan-2-amine?
The IUPAC name of 1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)propan-2-amine (CID 127007480) is 1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)propan-2-amine.
What is the SMILES notation for 1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)propan-2-amine?
The canonical SMILES for 1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)propan-2-amine is CC(N)CN1CCC=C(F)C1.
What is the InChIKey of 1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)propan-2-amine?
The InChIKey is JAKMITZYNHPGNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15FN2/c1-7(10)5-11-4-2-3-8(9)6-11/h3,7H,2,4-6,10H2,1H3.
What are the key properties of 1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)propan-2-amine?
1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)propan-2-amine has a molecular weight of 158.22 g/mol, XLogP of 0.89, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)propan-2-amine is sourced from PubChem (CID 127007480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).