2-fluoro-2-(pyridin-3-ylmethyl)pentan-1-amine

C11H17FN2 — CID 104737462

IUPAC2-fluoro-2-(pyridin-3-ylmethyl)pentan-1-amine
SMILESCCCC(F)(CN)Cc1cccnc1
InChIInChI=1S/C11H17FN2/c1-2-5-11(12,9-13)7-10-4-3-6-14-8-10/h3-4,6,8H,2,5,7,9,13H2,1H3
InChIKeyCFMWYVSOTNHKGY-UHFFFAOYSA-N
MW196.27 g/mol
LogP2.09
Rot. Bonds5

About 2-fluoro-2-(pyridin-3-ylmethyl)pentan-1-amine

2-fluoro-2-(pyridin-3-ylmethyl)pentan-1-amine (PubChem CID 104737462) has the molecular formula C11H17FN2 and a molecular weight of 196.27 g/mol. Its IUPAC name is 2-fluoro-2-(pyridin-3-ylmethyl)pentan-1-amine.

Molecular Properties

Compound Name2-fluoro-2-(pyridin-3-ylmethyl)pentan-1-amine
PubChem CID104737462
Molecular FormulaC11H17FN2
Molecular Weight196.27 g/mol
Exact Mass196.14
IUPAC Name2-fluoro-2-(pyridin-3-ylmethyl)pentan-1-amine
SMILESCCCC(F)(CN)Cc1cccnc1
InChIInChI=1S/C11H17FN2/c1-2-5-11(12,9-13)7-10-4-3-6-14-8-10/h3-4,6,8H,2,5,7,9,13H2,1H3
InChIKeyCFMWYVSOTNHKGY-UHFFFAOYSA-N
XLogP2.09
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.27
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-3-methyl-2-(pyridin-3-ylmethyl)butan-1-amine
CID 104737459
1-amino-3,3-dimethyl-2-(pyridin-3-ylmethyl)butan-2-ol
CID 104735827
4-pyridin-3-yl-3-(pyridin-3-ylmethyl)butane-1,3-diamine
CID 174709690
2-methyl-1-pyridin-3-ylpropan-2-amine;dihydrochloride
CID 131637820
3-amino-3-methyl-1-pyridin-3-ylhexan-2-one
CID 116557063
3-(2,2-dimethylpropyl)pyridine;methane
CID 160666805
3-ethylpyridine
CID 10823
2-(3-fluorophenyl)-1-pyridin-3-ylbutan-2-amine
CID 114872773
1,1-bis(4-fluorophenyl)-2-pyridin-3-ylethanol
CID 23036417
2-amino-2-methyl-N-(pyridin-3-ylmethyl)pentanamide
CID 60848389
1-(pyridin-3-ylmethylamino)butan-2-ol
CID 18726795
2-methyl-N-propyl-N-(2-pyridin-3-ylethyl)propan-2-amine
CID 59134912

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-(pyridin-3-ylmethyl)pentan-1-amine?
The IUPAC name of 2-fluoro-2-(pyridin-3-ylmethyl)pentan-1-amine (CID 104737462) is 2-fluoro-2-(pyridin-3-ylmethyl)pentan-1-amine.
What is the SMILES notation for 2-fluoro-2-(pyridin-3-ylmethyl)pentan-1-amine?
The canonical SMILES for 2-fluoro-2-(pyridin-3-ylmethyl)pentan-1-amine is CCCC(F)(CN)Cc1cccnc1.
What is the InChIKey of 2-fluoro-2-(pyridin-3-ylmethyl)pentan-1-amine?
The InChIKey is CFMWYVSOTNHKGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17FN2/c1-2-5-11(12,9-13)7-10-4-3-6-14-8-10/h3-4,6,8H,2,5,7,9,13H2,1H3.
What are the key properties of 2-fluoro-2-(pyridin-3-ylmethyl)pentan-1-amine?
2-fluoro-2-(pyridin-3-ylmethyl)pentan-1-amine has a molecular weight of 196.27 g/mol, XLogP of 2.09, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-(pyridin-3-ylmethyl)pentan-1-amine is sourced from PubChem (CID 104737462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).