(3R,4R)-4-fluoro-1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine

C10H14FN3 — CID 163295914

IUPAC(3R,4R)-4-fluoro-1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine
SMILESCc1ccc(N2C[C@@H](N)[C@H](F)C2)cn1
InChIInChI=1S/C10H14FN3/c1-7-2-3-8(4-13-7)14-5-9(11)10(12)6-14/h2-4,9-10H,5-6,12H2,1H3/t9-,10-/m1/s1
InChIKeyLPRJJXSSXZCTGZ-NXEZZACHSA-N
MW195.24 g/mol
LogP0.88
Rot. Bonds1

About (3R,4R)-4-fluoro-1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine

(3R,4R)-4-fluoro-1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine (PubChem CID 163295914) has the molecular formula C10H14FN3 and a molecular weight of 195.24 g/mol. Its IUPAC name is (3R,4R)-4-fluoro-1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine.

Molecular Properties

Compound Name(3R,4R)-4-fluoro-1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine
PubChem CID163295914
Molecular FormulaC10H14FN3
Molecular Weight195.24 g/mol
Exact Mass195.12
IUPAC Name(3R,4R)-4-fluoro-1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine
SMILESCc1ccc(N2C[C@@H](N)[C@H](F)C2)cn1
InChIInChI=1S/C10H14FN3/c1-7-2-3-8(4-13-7)14-5-9(11)10(12)6-14/h2-4,9-10H,5-6,12H2,1H3/t9-,10-/m1/s1
InChIKeyLPRJJXSSXZCTGZ-NXEZZACHSA-N
XLogP0.88
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine
CID 164882777
4-fluoro-1-(6-methyl-3-pyridinyl)piperidin-3-ol
CID 172576145
5-(3-fluoropiperidin-1-yl)-2-methylpyridine
CID 156752811
2-(6-methyl-3-pyridinyl)-1,3-dihydroisoindole
CID 118459671
(1R,6S)-3-(6-methyl-3-pyridinyl)-3,8-diazabicyclo[4.2.0]octane
CID 66757628
1-(6-fluoro-3-pyridinyl)pyrrolidin-3-amine
CID 66854552
2-methyl-5-(4-methylsulfanylpiperidin-1-yl)pyridine
CID 123718410
[1,6-dimethyl-4-(6-methyl-3-pyridinyl)-1,4-diazepan-2-yl]methanol
CID 91130399
ethane;1-[1-(6-methyl-3-pyridinyl)piperidin-4-yl]ethanol
CID 156652004
2-tert-butyl-4-(6-methyl-3-pyridinyl)morpholine;ethane
CID 156651571
5-[3-(methoxymethyl)piperidin-1-yl]-2-methylpyridine
CID 164927032
(1R)-1-[(3R)-1-(6-methyl-3-pyridinyl)piperidin-3-yl]ethanol
CID 166682628

Frequently Asked Questions

What is the IUPAC name of (3R,4R)-4-fluoro-1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine?
The IUPAC name of (3R,4R)-4-fluoro-1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine (CID 163295914) is (3R,4R)-4-fluoro-1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine.
What is the SMILES notation for (3R,4R)-4-fluoro-1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine?
The canonical SMILES for (3R,4R)-4-fluoro-1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine is Cc1ccc(N2C[C@@H](N)[C@H](F)C2)cn1.
What is the InChIKey of (3R,4R)-4-fluoro-1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine?
The InChIKey is LPRJJXSSXZCTGZ-NXEZZACHSA-N. The full InChI is InChI=1S/C10H14FN3/c1-7-2-3-8(4-13-7)14-5-9(11)10(12)6-14/h2-4,9-10H,5-6,12H2,1H3/t9-,10-/m1/s1.
What are the key properties of (3R,4R)-4-fluoro-1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine?
(3R,4R)-4-fluoro-1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine has a molecular weight of 195.24 g/mol, XLogP of 0.88, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4R)-4-fluoro-1-(6-methyl-3-pyridinyl)pyrrolidin-3-amine is sourced from PubChem (CID 163295914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).