2-[(3R)-3-aminopiperidin-1-yl]-N-(2-chlorophenyl)acetamide

C13H18ClN3O — CID 102977528

IUPAC2-[(3R)-3-aminopiperidin-1-yl]-N-(2-chlorophenyl)acetamide
SMILESN[C@@H]1CCCN(CC(=O)Nc2ccccc2Cl)C1
InChIInChI=1S/C13H18ClN3O/c14-11-5-1-2-6-12(11)16-13(18)9-17-7-3-4-10(15)8-17/h1-2,5-6,10H,3-4,7-9,15H2,(H,16,18)/t10-/m1/s1
InChIKeyLNKMSKLXZZEKPM-SNVBAGLBSA-N
MW267.76 g/mol
LogP1.70
Rot. Bonds3

About 2-[(3R)-3-aminopiperidin-1-yl]-N-(2-chlorophenyl)acetamide

2-[(3R)-3-aminopiperidin-1-yl]-N-(2-chlorophenyl)acetamide (PubChem CID 102977528) has the molecular formula C13H18ClN3O and a molecular weight of 267.76 g/mol. Its IUPAC name is 2-[(3R)-3-aminopiperidin-1-yl]-N-(2-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-[(3R)-3-aminopiperidin-1-yl]-N-(2-chlorophenyl)acetamide
PubChem CID102977528
Molecular FormulaC13H18ClN3O
Molecular Weight267.76 g/mol
Exact Mass267.11
IUPAC Name2-[(3R)-3-aminopiperidin-1-yl]-N-(2-chlorophenyl)acetamide
SMILESN[C@@H]1CCCN(CC(=O)Nc2ccccc2Cl)C1
InChIInChI=1S/C13H18ClN3O/c14-11-5-1-2-6-12(11)16-13(18)9-17-7-3-4-10(15)8-17/h1-2,5-6,10H,3-4,7-9,15H2,(H,16,18)/t10-/m1/s1
InChIKeyLNKMSKLXZZEKPM-SNVBAGLBSA-N
XLogP1.70
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-aminopiperidin-1-yl)-N-(2,3-dichlorophenyl)acetamide;hydrochloride
CID 119910035
2-(3-aminopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide
CID 61298143
N-(2-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide
CID 62546007
N-(2-chlorophenyl)-2-pyrrolidin-1-ylacetamide;hydrochloride
CID 24832355
2-(azepan-1-yl)-N-(2-chlorophenyl)acetamide
CID 2070988
ethyl 1-[2-(2-chloroanilino)-2-oxoethyl]piperidine-3-carboxylate
CID 51170832
N-[2-[(3R)-3-aminopiperidin-1-yl]acetyl]-2-chlorobenzamide
CID 102985024
2-(4-amino-3-methylpiperidin-1-yl)-N-(2-chlorophenyl)acetamide;hydrochloride
CID 119925180
3-(4-aminopiperidin-1-yl)-N-(2-chlorophenyl)propanamide
CID 43556671
methyl 1-[2-(2-chloroanilino)-2-oxoethyl]pyrrolidine-3-carboxylate
CID 47287034
N-(2-chlorophenyl)-2-(3,9-diazabicyclo[4.2.1]nonan-3-yl)acetamide
CID 81491367
2-[(3R)-3-aminopiperidin-1-yl]-N-(2,6-dichloro-3-methylphenyl)acetamide
CID 102977279

Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-3-aminopiperidin-1-yl]-N-(2-chlorophenyl)acetamide?
The IUPAC name of 2-[(3R)-3-aminopiperidin-1-yl]-N-(2-chlorophenyl)acetamide (CID 102977528) is 2-[(3R)-3-aminopiperidin-1-yl]-N-(2-chlorophenyl)acetamide.
What is the SMILES notation for 2-[(3R)-3-aminopiperidin-1-yl]-N-(2-chlorophenyl)acetamide?
The canonical SMILES for 2-[(3R)-3-aminopiperidin-1-yl]-N-(2-chlorophenyl)acetamide is N[C@@H]1CCCN(CC(=O)Nc2ccccc2Cl)C1.
What is the InChIKey of 2-[(3R)-3-aminopiperidin-1-yl]-N-(2-chlorophenyl)acetamide?
The InChIKey is LNKMSKLXZZEKPM-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H18ClN3O/c14-11-5-1-2-6-12(11)16-13(18)9-17-7-3-4-10(15)8-17/h1-2,5-6,10H,3-4,7-9,15H2,(H,16,18)/t10-/m1/s1.
What are the key properties of 2-[(3R)-3-aminopiperidin-1-yl]-N-(2-chlorophenyl)acetamide?
2-[(3R)-3-aminopiperidin-1-yl]-N-(2-chlorophenyl)acetamide has a molecular weight of 267.76 g/mol, XLogP of 1.70, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-3-aminopiperidin-1-yl]-N-(2-chlorophenyl)acetamide is sourced from PubChem (CID 102977528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).