2-(2-chloro-6-fluorophenyl)-N-methyl-N-piperidin-4-ylacetamide

C14H18ClFN2O — CID 43602048

IUPAC2-(2-chloro-6-fluorophenyl)-N-methyl-N-piperidin-4-ylacetamide
SMILESCN(C(=O)Cc1c(F)cccc1Cl)C1CCNCC1
InChIInChI=1S/C14H18ClFN2O/c1-18(10-5-7-17-8-6-10)14(19)9-11-12(15)3-2-4-13(11)16/h2-4,10,17H,5-9H2,1H3
InChIKeyKTJFBQFVIFHWNA-UHFFFAOYSA-N
MW284.76 g/mol
LogP2.23
Rot. Bonds3

About 2-(2-chloro-6-fluorophenyl)-N-methyl-N-piperidin-4-ylacetamide

2-(2-chloro-6-fluorophenyl)-N-methyl-N-piperidin-4-ylacetamide (PubChem CID 43602048) has the molecular formula C14H18ClFN2O and a molecular weight of 284.76 g/mol. Its IUPAC name is 2-(2-chloro-6-fluorophenyl)-N-methyl-N-piperidin-4-ylacetamide.

Molecular Properties

Compound Name2-(2-chloro-6-fluorophenyl)-N-methyl-N-piperidin-4-ylacetamide
PubChem CID43602048
Molecular FormulaC14H18ClFN2O
Molecular Weight284.76 g/mol
Exact Mass284.11
IUPAC Name2-(2-chloro-6-fluorophenyl)-N-methyl-N-piperidin-4-ylacetamide
SMILESCN(C(=O)Cc1c(F)cccc1Cl)C1CCNCC1
InChIInChI=1S/C14H18ClFN2O/c1-18(10-5-7-17-8-6-10)14(19)9-11-12(15)3-2-4-13(11)16/h2-4,10,17H,5-9H2,1H3
InChIKeyKTJFBQFVIFHWNA-UHFFFAOYSA-N
XLogP2.23
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.76
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(azepan-4-yl)-2-(2-chloro-6-fluorophenyl)-N-methylacetamide
CID 104974489
2-(2,6-dichlorophenyl)-N-methyl-N-piperidin-4-ylacetamide
CID 119444226
2-(2-chloro-6-fluorophenyl)-N-ethyl-N-(piperidin-4-ylmethyl)acetamide
CID 79698350
N-[(2-chloro-6-fluorophenyl)methyl]-N-methylpiperidine-4-carboxamide;hydrochloride
CID 119267724
N-[(2-chloro-6-fluorophenyl)methyl]-N-methyl-2-piperidin-4-ylacetamide;hydrochloride
CID 119682888
3-(2,3-difluorophenyl)-N-methyl-N-piperidin-4-ylpropanamide;hydrochloride
CID 119441407
2-[(2-chloro-6-fluorophenyl)methyl-piperidin-4-ylamino]acetamide
CID 60801937
2-(2-chloro-6-fluorophenyl)-N-cyclopropyl-N-(pyrrolidin-2-ylmethyl)acetamide
CID 104974055
2-(2-chlorophenyl)-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119553666
2-[[2-(2-chloro-6-fluorophenyl)acetyl]-cyclopropylamino]acetic acid
CID 54945915
N-[(2-chloro-6-fluorophenyl)methyl]-N-ethylpiperidin-4-amine
CID 60806803
2-(2-chloro-6-fluorophenyl)-N-pyrrolidin-3-ylacetamide
CID 55068411

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-6-fluorophenyl)-N-methyl-N-piperidin-4-ylacetamide?
The IUPAC name of 2-(2-chloro-6-fluorophenyl)-N-methyl-N-piperidin-4-ylacetamide (CID 43602048) is 2-(2-chloro-6-fluorophenyl)-N-methyl-N-piperidin-4-ylacetamide.
What is the SMILES notation for 2-(2-chloro-6-fluorophenyl)-N-methyl-N-piperidin-4-ylacetamide?
The canonical SMILES for 2-(2-chloro-6-fluorophenyl)-N-methyl-N-piperidin-4-ylacetamide is CN(C(=O)Cc1c(F)cccc1Cl)C1CCNCC1.
What is the InChIKey of 2-(2-chloro-6-fluorophenyl)-N-methyl-N-piperidin-4-ylacetamide?
The InChIKey is KTJFBQFVIFHWNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClFN2O/c1-18(10-5-7-17-8-6-10)14(19)9-11-12(15)3-2-4-13(11)16/h2-4,10,17H,5-9H2,1H3.
What are the key properties of 2-(2-chloro-6-fluorophenyl)-N-methyl-N-piperidin-4-ylacetamide?
2-(2-chloro-6-fluorophenyl)-N-methyl-N-piperidin-4-ylacetamide has a molecular weight of 284.76 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-6-fluorophenyl)-N-methyl-N-piperidin-4-ylacetamide is sourced from PubChem (CID 43602048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).