N-(3,4-dichlorophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide

C14H19Cl2N3O — CID 43607288

IUPACN-(3,4-dichlorophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide
SMILESCN(CC(=O)Nc1ccc(Cl)c(Cl)c1)C1CCNCC1
InChIInChI=1S/C14H19Cl2N3O/c1-19(11-4-6-17-7-5-11)9-14(20)18-10-2-3-12(15)13(16)8-10/h2-3,8,11,17H,4-7,9H2,1H3,(H,18,20)
InChIKeyOOQVKHYUAGCRRE-UHFFFAOYSA-N
MW316.23 g/mol
LogP2.62
Rot. Bonds4

About N-(3,4-dichlorophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide

N-(3,4-dichlorophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide (PubChem CID 43607288) has the molecular formula C14H19Cl2N3O and a molecular weight of 316.23 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide
PubChem CID43607288
Molecular FormulaC14H19Cl2N3O
Molecular Weight316.23 g/mol
Exact Mass315.09
IUPAC NameN-(3,4-dichlorophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide
SMILESCN(CC(=O)Nc1ccc(Cl)c(Cl)c1)C1CCNCC1
InChIInChI=1S/C14H19Cl2N3O/c1-19(11-4-6-17-7-5-11)9-14(20)18-10-2-3-12(15)13(16)8-10/h2-3,8,11,17H,4-7,9H2,1H3,(H,18,20)
InChIKeyOOQVKHYUAGCRRE-UHFFFAOYSA-N
XLogP2.62
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.23
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chloro-4-methylphenyl)-2-[methyl(piperidin-4-yl)amino]acetamide
CID 43607404
N-(3,4-dichlorophenyl)-2-[methyl(piperidin-4-ylmethyl)amino]acetamide;hydrochloride
CID 119929550
N-[2-(3,4-dichloroanilino)-2-oxoethyl]-N-methylpyrrolidine-3-carboxamide;hydrochloride
CID 119682947
N-(3-bromophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide
CID 43607437
2-[methyl(piperidin-4-yl)amino]-N-(3-propan-2-ylphenyl)acetamide;hydrochloride
CID 119912537
2-[[(1S,3R)-3-cyanocyclopentyl]-methylamino]-N-(3,4-dichlorophenyl)acetamide
CID 124847741
2-[[(1R,3S)-3-cyanocyclopentyl]-methylamino]-N-(3,4-dichlorophenyl)acetamide
CID 124847739
2-[[(1R,3R)-3-cyanocyclopentyl]-methylamino]-N-(3,4-dichlorophenyl)acetamide
CID 124847742
N-(4-cyanophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide
CID 43607310
N-(3-ethylphenyl)-2-[methyl(piperidin-4-yl)amino]acetamide
CID 43607180
N-(2-chloro-4-methylphenyl)-2-[methyl(piperidin-4-yl)amino]acetamide
CID 43607229
N-(3,4-dichlorophenyl)-2-piperidin-4-ylacetamide;hydrochloride
CID 119670897

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide?
The IUPAC name of N-(3,4-dichlorophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide (CID 43607288) is N-(3,4-dichlorophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide?
The canonical SMILES for N-(3,4-dichlorophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide is CN(CC(=O)Nc1ccc(Cl)c(Cl)c1)C1CCNCC1.
What is the InChIKey of N-(3,4-dichlorophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide?
The InChIKey is OOQVKHYUAGCRRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19Cl2N3O/c1-19(11-4-6-17-7-5-11)9-14(20)18-10-2-3-12(15)13(16)8-10/h2-3,8,11,17H,4-7,9H2,1H3,(H,18,20).
What are the key properties of N-(3,4-dichlorophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide?
N-(3,4-dichlorophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide has a molecular weight of 316.23 g/mol, XLogP of 2.62, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)-2-[methyl(piperidin-4-yl)amino]acetamide is sourced from PubChem (CID 43607288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).