N-(2,6-dichlorophenyl)-2-[ethyl(piperidin-4-ylmethyl)amino]acetamide;hydrochloride

C16H24Cl3N3O — CID 119929877

IUPACN-(2,6-dichlorophenyl)-2-[ethyl(piperidin-4-ylmethyl)amino]acetamide;hydrochloride
SMILESCCN(CC(=O)Nc1c(Cl)cccc1Cl)CC1CCNCC1.Cl
InChIInChI=1S/C16H23Cl2N3O.ClH/c1-2-21(10-12-6-8-19-9-7-12)11-15(22)20-16-13(17)4-3-5-14(16)18;/h3-5,12,19H,2,6-11H2,1H3,(H,20,22);1H
InChIKeyCRCZIHKSVCTKQN-UHFFFAOYSA-N
MW380.75 g/mol
LogP3.68
Rot. Bonds6

About N-(2,6-dichlorophenyl)-2-[ethyl(piperidin-4-ylmethyl)amino]acetamide;hydrochloride

N-(2,6-dichlorophenyl)-2-[ethyl(piperidin-4-ylmethyl)amino]acetamide;hydrochloride (PubChem CID 119929877) has the molecular formula C16H24Cl3N3O and a molecular weight of 380.75 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-2-[ethyl(piperidin-4-ylmethyl)amino]acetamide;hydrochloride.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-2-[ethyl(piperidin-4-ylmethyl)amino]acetamide;hydrochloride
PubChem CID119929877
Molecular FormulaC16H24Cl3N3O
Molecular Weight380.75 g/mol
Exact Mass379.10
IUPAC NameN-(2,6-dichlorophenyl)-2-[ethyl(piperidin-4-ylmethyl)amino]acetamide;hydrochloride
SMILESCCN(CC(=O)Nc1c(Cl)cccc1Cl)CC1CCNCC1.Cl
InChIInChI=1S/C16H23Cl2N3O.ClH/c1-2-21(10-12-6-8-19-9-7-12)11-15(22)20-16-13(17)4-3-5-14(16)18;/h3-5,12,19H,2,6-11H2,1H3,(H,20,22);1H
InChIKeyCRCZIHKSVCTKQN-UHFFFAOYSA-N
XLogP3.68
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.75
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-2-[ethyl(piperidin-4-ylmethyl)amino]acetamide;hydrochloride?
The IUPAC name of N-(2,6-dichlorophenyl)-2-[ethyl(piperidin-4-ylmethyl)amino]acetamide;hydrochloride (CID 119929877) is N-(2,6-dichlorophenyl)-2-[ethyl(piperidin-4-ylmethyl)amino]acetamide;hydrochloride.
What is the SMILES notation for N-(2,6-dichlorophenyl)-2-[ethyl(piperidin-4-ylmethyl)amino]acetamide;hydrochloride?
The canonical SMILES for N-(2,6-dichlorophenyl)-2-[ethyl(piperidin-4-ylmethyl)amino]acetamide;hydrochloride is CCN(CC(=O)Nc1c(Cl)cccc1Cl)CC1CCNCC1.Cl.
What is the InChIKey of N-(2,6-dichlorophenyl)-2-[ethyl(piperidin-4-ylmethyl)amino]acetamide;hydrochloride?
The InChIKey is CRCZIHKSVCTKQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23Cl2N3O.ClH/c1-2-21(10-12-6-8-19-9-7-12)11-15(22)20-16-13(17)4-3-5-14(16)18;/h3-5,12,19H,2,6-11H2,1H3,(H,20,22);1H.
What are the key properties of N-(2,6-dichlorophenyl)-2-[ethyl(piperidin-4-ylmethyl)amino]acetamide;hydrochloride?
N-(2,6-dichlorophenyl)-2-[ethyl(piperidin-4-ylmethyl)amino]acetamide;hydrochloride has a molecular weight of 380.75 g/mol, XLogP of 3.68, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-2-[ethyl(piperidin-4-ylmethyl)amino]acetamide;hydrochloride is sourced from PubChem (CID 119929877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).