N-(2,4-difluorophenyl)-2-(3-methylpiperidin-1-yl)acetamide

C14H18F2N2O — CID 4824448

IUPACN-(2,4-difluorophenyl)-2-(3-methylpiperidin-1-yl)acetamide
SMILESCC1CCCN(CC(=O)Nc2ccc(F)cc2F)C1
InChIInChI=1S/C14H18F2N2O/c1-10-3-2-6-18(8-10)9-14(19)17-13-5-4-11(15)7-12(13)16/h4-5,7,10H,2-3,6,8-9H2,1H3,(H,17,19)
InChIKeyIIFLZZMBZSASCL-UHFFFAOYSA-N
MW268.31 g/mol
LogP2.64
Rot. Bonds3

About N-(2,4-difluorophenyl)-2-(3-methylpiperidin-1-yl)acetamide

N-(2,4-difluorophenyl)-2-(3-methylpiperidin-1-yl)acetamide (PubChem CID 4824448) has the molecular formula C14H18F2N2O and a molecular weight of 268.31 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-2-(3-methylpiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-2-(3-methylpiperidin-1-yl)acetamide
PubChem CID4824448
Molecular FormulaC14H18F2N2O
Molecular Weight268.31 g/mol
Exact Mass268.14
IUPAC NameN-(2,4-difluorophenyl)-2-(3-methylpiperidin-1-yl)acetamide
SMILESCC1CCCN(CC(=O)Nc2ccc(F)cc2F)C1
InChIInChI=1S/C14H18F2N2O/c1-10-3-2-6-18(8-10)9-14(19)17-13-5-4-11(15)7-12(13)16/h4-5,7,10H,2-3,6,8-9H2,1H3,(H,17,19)
InChIKeyIIFLZZMBZSASCL-UHFFFAOYSA-N
XLogP2.64
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.31
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-2-(3-methylpiperidin-1-yl)acetamide?
The IUPAC name of N-(2,4-difluorophenyl)-2-(3-methylpiperidin-1-yl)acetamide (CID 4824448) is N-(2,4-difluorophenyl)-2-(3-methylpiperidin-1-yl)acetamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-2-(3-methylpiperidin-1-yl)acetamide?
The canonical SMILES for N-(2,4-difluorophenyl)-2-(3-methylpiperidin-1-yl)acetamide is CC1CCCN(CC(=O)Nc2ccc(F)cc2F)C1.
What is the InChIKey of N-(2,4-difluorophenyl)-2-(3-methylpiperidin-1-yl)acetamide?
The InChIKey is IIFLZZMBZSASCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F2N2O/c1-10-3-2-6-18(8-10)9-14(19)17-13-5-4-11(15)7-12(13)16/h4-5,7,10H,2-3,6,8-9H2,1H3,(H,17,19).
What are the key properties of N-(2,4-difluorophenyl)-2-(3-methylpiperidin-1-yl)acetamide?
N-(2,4-difluorophenyl)-2-(3-methylpiperidin-1-yl)acetamide has a molecular weight of 268.31 g/mol, XLogP of 2.64, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-2-(3-methylpiperidin-1-yl)acetamide is sourced from PubChem (CID 4824448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).