2-(3-aminopiperidin-1-yl)-N-(2,3-dichlorophenyl)acetamide;hydrochloride

C13H18Cl3N3O — CID 119910035

IUPAC2-(3-aminopiperidin-1-yl)-N-(2,3-dichlorophenyl)acetamide;hydrochloride
SMILESCl.NC1CCCN(CC(=O)Nc2cccc(Cl)c2Cl)C1
InChIInChI=1S/C13H17Cl2N3O.ClH/c14-10-4-1-5-11(13(10)15)17-12(19)8-18-6-2-3-9(16)7-18;/h1,4-5,9H,2-3,6-8,16H2,(H,17,19);1H
InChIKeyLJFTXQWNMHGDFX-UHFFFAOYSA-N
MW338.67 g/mol
LogP2.78
Rot. Bonds3

About 2-(3-aminopiperidin-1-yl)-N-(2,3-dichlorophenyl)acetamide;hydrochloride

2-(3-aminopiperidin-1-yl)-N-(2,3-dichlorophenyl)acetamide;hydrochloride (PubChem CID 119910035) has the molecular formula C13H18Cl3N3O and a molecular weight of 338.67 g/mol. Its IUPAC name is 2-(3-aminopiperidin-1-yl)-N-(2,3-dichlorophenyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(3-aminopiperidin-1-yl)-N-(2,3-dichlorophenyl)acetamide;hydrochloride
PubChem CID119910035
Molecular FormulaC13H18Cl3N3O
Molecular Weight338.67 g/mol
Exact Mass337.05
IUPAC Name2-(3-aminopiperidin-1-yl)-N-(2,3-dichlorophenyl)acetamide;hydrochloride
SMILESCl.NC1CCCN(CC(=O)Nc2cccc(Cl)c2Cl)C1
InChIInChI=1S/C13H17Cl2N3O.ClH/c14-10-4-1-5-11(13(10)15)17-12(19)8-18-6-2-3-9(16)7-18;/h1,4-5,9H,2-3,6-8,16H2,(H,17,19);1H
InChIKeyLJFTXQWNMHGDFX-UHFFFAOYSA-N
XLogP2.78
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.67
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3R)-3-aminopiperidin-1-yl]-N-(2-chlorophenyl)acetamide
CID 102977528
N-(2,3-dichlorophenyl)-2-[3-(trifluoromethyl)piperidin-1-yl]acetamide
CID 46801707
2-(4-amino-3-methylpiperidin-1-yl)-N-(2,3-dichlorophenyl)acetamide;hydrochloride
CID 119924970
2-(3-aminopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide
CID 61298143
2-(3-aminopiperidin-1-yl)-N-(3-iodophenyl)acetamide;hydrochloride
CID 119910140
2-[3-(1-aminoethyl)pyrrolidin-1-yl]-N-(2,3-dichlorophenyl)acetamide
CID 115969224
N-[2-[(3R)-3-aminopiperidin-1-yl]acetyl]-2-chlorobenzamide
CID 102985024
2-[(3R)-3-aminopiperidin-1-yl]-N-(2,6-dichloro-3-methylphenyl)acetamide
CID 102977279
N-(3-chloro-2-methylphenyl)-2-[3-(methylaminomethyl)piperidin-1-yl]acetamide;hydrochloride
CID 119914494
N-(2,3-dichlorophenyl)-2-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]acetamide
CID 42918042
2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2,4,5-trichlorophenyl)acetamide;hydrochloride
CID 119905192
N-(2-chlorophenyl)-2-pyrrolidin-1-ylacetamide;hydrochloride
CID 24832355

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminopiperidin-1-yl)-N-(2,3-dichlorophenyl)acetamide;hydrochloride?
The IUPAC name of 2-(3-aminopiperidin-1-yl)-N-(2,3-dichlorophenyl)acetamide;hydrochloride (CID 119910035) is 2-(3-aminopiperidin-1-yl)-N-(2,3-dichlorophenyl)acetamide;hydrochloride.
What is the SMILES notation for 2-(3-aminopiperidin-1-yl)-N-(2,3-dichlorophenyl)acetamide;hydrochloride?
The canonical SMILES for 2-(3-aminopiperidin-1-yl)-N-(2,3-dichlorophenyl)acetamide;hydrochloride is Cl.NC1CCCN(CC(=O)Nc2cccc(Cl)c2Cl)C1.
What is the InChIKey of 2-(3-aminopiperidin-1-yl)-N-(2,3-dichlorophenyl)acetamide;hydrochloride?
The InChIKey is LJFTXQWNMHGDFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17Cl2N3O.ClH/c14-10-4-1-5-11(13(10)15)17-12(19)8-18-6-2-3-9(16)7-18;/h1,4-5,9H,2-3,6-8,16H2,(H,17,19);1H.
What are the key properties of 2-(3-aminopiperidin-1-yl)-N-(2,3-dichlorophenyl)acetamide;hydrochloride?
2-(3-aminopiperidin-1-yl)-N-(2,3-dichlorophenyl)acetamide;hydrochloride has a molecular weight of 338.67 g/mol, XLogP of 2.78, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminopiperidin-1-yl)-N-(2,3-dichlorophenyl)acetamide;hydrochloride is sourced from PubChem (CID 119910035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).