(2R,3R)-2-(3-chlorophenyl)piperidin-3-amine

C11H15ClN2 — CID 22880723

IUPAC(2R,3R)-2-(3-chlorophenyl)piperidin-3-amine
SMILESN[C@@H]1CCCN[C@@H]1c1cccc(Cl)c1
InChIInChI=1S/C11H15ClN2/c12-9-4-1-3-8(7-9)11-10(13)5-2-6-14-11/h1,3-4,7,10-11,14H,2,5-6,13H2/t10-,11-/m1/s1
InChIKeyCIFBTUDQBBZGFL-GHMZBOCLSA-N
MW210.71 g/mol
LogP2.09
Rot. Bonds1

About (2R,3R)-2-(3-chlorophenyl)piperidin-3-amine

(2R,3R)-2-(3-chlorophenyl)piperidin-3-amine (PubChem CID 22880723) has the molecular formula C11H15ClN2 and a molecular weight of 210.71 g/mol. Its IUPAC name is (2R,3R)-2-(3-chlorophenyl)piperidin-3-amine.

Molecular Properties

Compound Name(2R,3R)-2-(3-chlorophenyl)piperidin-3-amine
PubChem CID22880723
Molecular FormulaC11H15ClN2
Molecular Weight210.71 g/mol
Exact Mass210.09
IUPAC Name(2R,3R)-2-(3-chlorophenyl)piperidin-3-amine
SMILESN[C@@H]1CCCN[C@@H]1c1cccc(Cl)c1
InChIInChI=1S/C11H15ClN2/c12-9-4-1-3-8(7-9)11-10(13)5-2-6-14-11/h1,3-4,7,10-11,14H,2,5-6,13H2/t10-,11-/m1/s1
InChIKeyCIFBTUDQBBZGFL-GHMZBOCLSA-N
XLogP2.09
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.71
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R,3R)-2-(3-chlorophenyl)piperidin-3-amine?
The IUPAC name of (2R,3R)-2-(3-chlorophenyl)piperidin-3-amine (CID 22880723) is (2R,3R)-2-(3-chlorophenyl)piperidin-3-amine.
What is the SMILES notation for (2R,3R)-2-(3-chlorophenyl)piperidin-3-amine?
The canonical SMILES for (2R,3R)-2-(3-chlorophenyl)piperidin-3-amine is N[C@@H]1CCCN[C@@H]1c1cccc(Cl)c1.
What is the InChIKey of (2R,3R)-2-(3-chlorophenyl)piperidin-3-amine?
The InChIKey is CIFBTUDQBBZGFL-GHMZBOCLSA-N. The full InChI is InChI=1S/C11H15ClN2/c12-9-4-1-3-8(7-9)11-10(13)5-2-6-14-11/h1,3-4,7,10-11,14H,2,5-6,13H2/t10-,11-/m1/s1.
What are the key properties of (2R,3R)-2-(3-chlorophenyl)piperidin-3-amine?
(2R,3R)-2-(3-chlorophenyl)piperidin-3-amine has a molecular weight of 210.71 g/mol, XLogP of 2.09, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-2-(3-chlorophenyl)piperidin-3-amine is sourced from PubChem (CID 22880723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).