2-(3-aminopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide

C13H17Cl2N3O — CID 61298143

IUPAC2-(3-aminopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide
SMILESNC1CCCN(CC(=O)Nc2cc(Cl)ccc2Cl)C1
InChIInChI=1S/C13H17Cl2N3O/c14-9-3-4-11(15)12(6-9)17-13(19)8-18-5-1-2-10(16)7-18/h3-4,6,10H,1-2,5,7-8,16H2,(H,17,19)
InChIKeyREQDKLZHBWCSME-UHFFFAOYSA-N
MW302.20 g/mol
LogP2.36
Rot. Bonds3

About 2-(3-aminopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide

2-(3-aminopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide (PubChem CID 61298143) has the molecular formula C13H17Cl2N3O and a molecular weight of 302.20 g/mol. Its IUPAC name is 2-(3-aminopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-(3-aminopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide
PubChem CID61298143
Molecular FormulaC13H17Cl2N3O
Molecular Weight302.20 g/mol
Exact Mass301.07
IUPAC Name2-(3-aminopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide
SMILESNC1CCCN(CC(=O)Nc2cc(Cl)ccc2Cl)C1
InChIInChI=1S/C13H17Cl2N3O/c14-9-3-4-11(15)12(6-9)17-13(19)8-18-5-1-2-10(16)7-18/h3-4,6,10H,1-2,5,7-8,16H2,(H,17,19)
InChIKeyREQDKLZHBWCSME-UHFFFAOYSA-N
XLogP2.36
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.20
LogP ≤ 52.36
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-(2,5-dichlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide
CID 62545625
2-(4-amino-3-ethylpiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide
CID 81452927
2-(3-aminopiperidin-1-yl)-N-(2,3-dichlorophenyl)acetamide;hydrochloride
CID 119910035
2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2,4,5-trichlorophenyl)acetamide;hydrochloride
CID 119905192
2-(3-aminopiperidin-1-yl)-1-(2,4-dichlorophenyl)ethanone
CID 62037871
N-(5-amino-2-chlorophenyl)-2-(3-ethylpiperidin-1-yl)acetamide
CID 43584042
2-[(3R)-3-aminopiperidin-1-yl]-N-(2,6-dichloro-3-methylphenyl)acetamide
CID 102977279
N-(2,5-dichlorophenyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide;hydrochloride
CID 119922555
N-(2,5-dichlorophenyl)-2-[(3R)-3-methylpiperazin-1-yl]acetamide
CID 104975276
1-[2-(5-amino-2-chloroanilino)-2-oxoethyl]piperidine-3-carboxamide
CID 43375570
3-[3-(2-aminoethyl)piperidin-1-yl]-N-(2,5-dichlorophenyl)propanamide;hydrochloride
CID 120728374

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide?
The IUPAC name of 2-(3-aminopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide (CID 61298143) is 2-(3-aminopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide.
What is the SMILES notation for 2-(3-aminopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide?
The canonical SMILES for 2-(3-aminopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide is NC1CCCN(CC(=O)Nc2cc(Cl)ccc2Cl)C1.
What is the InChIKey of 2-(3-aminopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide?
The InChIKey is REQDKLZHBWCSME-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17Cl2N3O/c14-9-3-4-11(15)12(6-9)17-13(19)8-18-5-1-2-10(16)7-18/h3-4,6,10H,1-2,5,7-8,16H2,(H,17,19).
What are the key properties of 2-(3-aminopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide?
2-(3-aminopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide has a molecular weight of 302.20 g/mol, XLogP of 2.36, 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-(2,5-dichlorophenyl)acetamide is sourced from PubChem (CID 61298143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).