(3R)-1-[(3-fluorophenyl)methyl]piperidin-3-amine

C12H17FN2 — CID 24904616

IUPAC(3R)-1-[(3-fluorophenyl)methyl]piperidin-3-amine
SMILESN[C@@H]1CCCN(Cc2cccc(F)c2)C1
InChIInChI=1S/C12H17FN2/c13-11-4-1-3-10(7-11)8-15-6-2-5-12(14)9-15/h1,3-4,7,12H,2,5-6,8-9,14H2/t12-/m1/s1
InChIKeyIWWLKPPORQFPPZ-GFCCVEGCSA-N
MW208.28 g/mol
LogP1.75
Rot. Bonds2

About (3R)-1-[(3-fluorophenyl)methyl]piperidin-3-amine

(3R)-1-[(3-fluorophenyl)methyl]piperidin-3-amine (PubChem CID 24904616) has the molecular formula C12H17FN2 and a molecular weight of 208.28 g/mol. Its IUPAC name is (3R)-1-[(3-fluorophenyl)methyl]piperidin-3-amine.

Molecular Properties

Compound Name(3R)-1-[(3-fluorophenyl)methyl]piperidin-3-amine
PubChem CID24904616
Molecular FormulaC12H17FN2
Molecular Weight208.28 g/mol
Exact Mass208.14
IUPAC Name(3R)-1-[(3-fluorophenyl)methyl]piperidin-3-amine
SMILESN[C@@H]1CCCN(Cc2cccc(F)c2)C1
InChIInChI=1S/C12H17FN2/c13-11-4-1-3-10(7-11)8-15-6-2-5-12(14)9-15/h1,3-4,7,12H,2,5-6,8-9,14H2/t12-/m1/s1
InChIKeyIWWLKPPORQFPPZ-GFCCVEGCSA-N
XLogP1.75
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.28
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-1-[(3-methylphenyl)methyl]piperidin-3-amine
CID 24904607
(3R)-1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-amine
CID 24904810
(3R)-1-[(3-chloro-4-fluorophenyl)methyl]piperidin-3-amine
CID 24904788
(3S)-N-benzyl-1-[(3-fluorophenyl)methyl]piperidin-3-amine
CID 97082368
(3S,4S)-1-[(3-fluorophenyl)methyl]-3-methylpiperidin-4-ol
CID 129393398
1-[(3-phenylmethoxyphenyl)methyl]piperidin-3-amine;hydrochloride
CID 119910073
(3S)-1-[(4-fluoro-2-methylphenyl)methyl]piperidin-3-amine
CID 24904859
1-[(2-bromo-5-fluorophenyl)methyl]piperidin-3-amine;hydrochloride
CID 119910188
1-[(3-fluorophenyl)methyl]pyrrolidine-3-carboxamide
CID 175878823
(3R)-1-[(2-chloro-5-fluorophenyl)methyl]piperidin-3-amine;hydrochloride
CID 120967115
1-[[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-3-amine
CID 56770209
(3R)-1-[(4-phenylphenyl)methyl]piperidin-3-amine
CID 102977250

Frequently Asked Questions

What is the IUPAC name of (3R)-1-[(3-fluorophenyl)methyl]piperidin-3-amine?
The IUPAC name of (3R)-1-[(3-fluorophenyl)methyl]piperidin-3-amine (CID 24904616) is (3R)-1-[(3-fluorophenyl)methyl]piperidin-3-amine.
What is the SMILES notation for (3R)-1-[(3-fluorophenyl)methyl]piperidin-3-amine?
The canonical SMILES for (3R)-1-[(3-fluorophenyl)methyl]piperidin-3-amine is N[C@@H]1CCCN(Cc2cccc(F)c2)C1.
What is the InChIKey of (3R)-1-[(3-fluorophenyl)methyl]piperidin-3-amine?
The InChIKey is IWWLKPPORQFPPZ-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H17FN2/c13-11-4-1-3-10(7-11)8-15-6-2-5-12(14)9-15/h1,3-4,7,12H,2,5-6,8-9,14H2/t12-/m1/s1.
What are the key properties of (3R)-1-[(3-fluorophenyl)methyl]piperidin-3-amine?
(3R)-1-[(3-fluorophenyl)methyl]piperidin-3-amine has a molecular weight of 208.28 g/mol, XLogP of 1.75, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-[(3-fluorophenyl)methyl]piperidin-3-amine is sourced from PubChem (CID 24904616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).