2-[1-(2-chlorophenyl)piperidin-2-yl]ethanamine

C13H19ClN2 — CID 82388545

IUPAC2-[1-(2-chlorophenyl)piperidin-2-yl]ethanamine
SMILESNCCC1CCCCN1c1ccccc1Cl
InChIInChI=1S/C13H19ClN2/c14-12-6-1-2-7-13(12)16-10-4-3-5-11(16)8-9-15/h1-2,6-7,11H,3-5,8-10,15H2
InChIKeyNGXRNHHZAQBTGG-UHFFFAOYSA-N
MW238.76 g/mol
LogP3.05
Rot. Bonds3

About 2-[1-(2-chlorophenyl)piperidin-2-yl]ethanamine

2-[1-(2-chlorophenyl)piperidin-2-yl]ethanamine (PubChem CID 82388545) has the molecular formula C13H19ClN2 and a molecular weight of 238.76 g/mol. Its IUPAC name is 2-[1-(2-chlorophenyl)piperidin-2-yl]ethanamine.

Molecular Properties

Compound Name2-[1-(2-chlorophenyl)piperidin-2-yl]ethanamine
PubChem CID82388545
Molecular FormulaC13H19ClN2
Molecular Weight238.76 g/mol
Exact Mass238.12
IUPAC Name2-[1-(2-chlorophenyl)piperidin-2-yl]ethanamine
SMILESNCCC1CCCCN1c1ccccc1Cl
InChIInChI=1S/C13H19ClN2/c14-12-6-1-2-7-13(12)16-10-4-3-5-11(16)8-9-15/h1-2,6-7,11H,3-5,8-10,15H2
InChIKeyNGXRNHHZAQBTGG-UHFFFAOYSA-N
XLogP3.05
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.76
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(2-methoxyphenyl)piperidin-2-yl]ethanamine
CID 82389615
2-[2-(2-aminoethyl)piperidin-1-yl]-N-ethylbenzenesulfonamide
CID 63767418
2-[1-(2-methylquinolin-4-yl)piperidin-2-yl]ethanamine
CID 63767577
2-chloro-6-[2-(2-hydroxyethyl)piperidin-1-yl]benzenecarbothioamide
CID 55079597
2-chloro-N'-hydroxy-6-[2-(2-hydroxyethyl)piperidin-1-yl]benzenecarboximidamide
CID 76945268
4-(1-phenylpiperidin-2-yl)butan-1-amine
CID 70110239
2-[1-(4-methylphthalazin-1-yl)piperidin-2-yl]ethanamine
CID 63767576
[(2S)-1-(2-fluorophenyl)pyrrolidin-2-yl]methanamine
CID 130691324
2-[1-(4-chloro-1,3-thiazol-2-yl)piperidin-2-yl]ethanamine
CID 83155436
3-chloro-4-[2-(2-chloroethyl)piperidin-1-yl]pyridine
CID 79840944
[1-(2-fluorophenyl)piperidin-2-yl]methanol
CID 68536498
[2-(2-ethylazepan-1-yl)phenyl]methanamine
CID 104688934

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-chlorophenyl)piperidin-2-yl]ethanamine?
The IUPAC name of 2-[1-(2-chlorophenyl)piperidin-2-yl]ethanamine (CID 82388545) is 2-[1-(2-chlorophenyl)piperidin-2-yl]ethanamine.
What is the SMILES notation for 2-[1-(2-chlorophenyl)piperidin-2-yl]ethanamine?
The canonical SMILES for 2-[1-(2-chlorophenyl)piperidin-2-yl]ethanamine is NCCC1CCCCN1c1ccccc1Cl.
What is the InChIKey of 2-[1-(2-chlorophenyl)piperidin-2-yl]ethanamine?
The InChIKey is NGXRNHHZAQBTGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19ClN2/c14-12-6-1-2-7-13(12)16-10-4-3-5-11(16)8-9-15/h1-2,6-7,11H,3-5,8-10,15H2.
What are the key properties of 2-[1-(2-chlorophenyl)piperidin-2-yl]ethanamine?
2-[1-(2-chlorophenyl)piperidin-2-yl]ethanamine has a molecular weight of 238.76 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-chlorophenyl)piperidin-2-yl]ethanamine is sourced from PubChem (CID 82388545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).