(1R)-3-fluoro-1-pyridin-3-ylpropan-1-amine;hydrochloride

C8H12ClFN2 — CID 171201508

IUPAC(1R)-3-fluoro-1-pyridin-3-ylpropan-1-amine;hydrochloride
SMILESCl.N[C@H](CCF)c1cccnc1
InChIInChI=1S/C8H11FN2.ClH/c9-4-3-8(10)7-2-1-5-11-6-7;/h1-2,5-6,8H,3-4,10H2;1H/t8-;/m1./s1
InChIKeyQNARKHRNLKFUHO-DDWIOCJRSA-N
MW190.65 g/mol
LogP1.86
Rot. Bonds3

About (1R)-3-fluoro-1-pyridin-3-ylpropan-1-amine;hydrochloride

(1R)-3-fluoro-1-pyridin-3-ylpropan-1-amine;hydrochloride (PubChem CID 171201508) has the molecular formula C8H12ClFN2 and a molecular weight of 190.65 g/mol. Its IUPAC name is (1R)-3-fluoro-1-pyridin-3-ylpropan-1-amine;hydrochloride.

Molecular Properties

Compound Name(1R)-3-fluoro-1-pyridin-3-ylpropan-1-amine;hydrochloride
PubChem CID171201508
Molecular FormulaC8H12ClFN2
Molecular Weight190.65 g/mol
Exact Mass190.07
IUPAC Name(1R)-3-fluoro-1-pyridin-3-ylpropan-1-amine;hydrochloride
SMILESCl.N[C@H](CCF)c1cccnc1
InChIInChI=1S/C8H11FN2.ClH/c9-4-3-8(10)7-2-1-5-11-6-7;/h1-2,5-6,8H,3-4,10H2;1H/t8-;/m1./s1
InChIKeyQNARKHRNLKFUHO-DDWIOCJRSA-N
XLogP1.86
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.65
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-pyridin-3-ylpropane-1,3-diamine
CID 116932848
(1S)-1-pyridin-3-ylpentane-1,5-diamine;hydrochloride
CID 171221036
4-amino-4-pyridin-3-ylbutan-1-ol
CID 85412290
(4R)-4-amino-4-pyridin-3-ylbutan-1-ol
CID 15886729
4-methoxy-1-pyridin-3-ylpentan-1-amine
CID 105098535
(1S)-1-pyridin-3-ylhexan-1-amine
CID 94506966
2-amino-2-pyridin-3-ylethanol
CID 2734590
(1R)-3,3,3-trifluoro-1-pyridin-3-ylpropan-1-amine
CID 103689442
4-propan-2-yloxy-1-pyridin-3-ylbutan-1-amine
CID 21156680
(3S)-3-amino-3-pyridin-3-ylpropanenitrile;hydrochloride
CID 171259888
1-pyridin-3-yl-2-(2,2,2-trifluoroethoxy)ethanamine
CID 103214655
3-methylsulfonyl-1-pyridin-3-ylpropan-1-amine
CID 62602759

Frequently Asked Questions

What is the IUPAC name of (1R)-3-fluoro-1-pyridin-3-ylpropan-1-amine;hydrochloride?
The IUPAC name of (1R)-3-fluoro-1-pyridin-3-ylpropan-1-amine;hydrochloride (CID 171201508) is (1R)-3-fluoro-1-pyridin-3-ylpropan-1-amine;hydrochloride.
What is the SMILES notation for (1R)-3-fluoro-1-pyridin-3-ylpropan-1-amine;hydrochloride?
The canonical SMILES for (1R)-3-fluoro-1-pyridin-3-ylpropan-1-amine;hydrochloride is Cl.N[C@H](CCF)c1cccnc1.
What is the InChIKey of (1R)-3-fluoro-1-pyridin-3-ylpropan-1-amine;hydrochloride?
The InChIKey is QNARKHRNLKFUHO-DDWIOCJRSA-N. The full InChI is InChI=1S/C8H11FN2.ClH/c9-4-3-8(10)7-2-1-5-11-6-7;/h1-2,5-6,8H,3-4,10H2;1H/t8-;/m1./s1.
What are the key properties of (1R)-3-fluoro-1-pyridin-3-ylpropan-1-amine;hydrochloride?
(1R)-3-fluoro-1-pyridin-3-ylpropan-1-amine;hydrochloride has a molecular weight of 190.65 g/mol, XLogP of 1.86, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-3-fluoro-1-pyridin-3-ylpropan-1-amine;hydrochloride is sourced from PubChem (CID 171201508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).