N-(2,5-dimethylphenyl)-2-(4-fluoropiperidin-1-yl)acetamide

C15H21FN2O — CID 171701345

IUPACN-(2,5-dimethylphenyl)-2-(4-fluoropiperidin-1-yl)acetamide
SMILESCc1ccc(C)c(NC(=O)CN2CCC(F)CC2)c1
InChIInChI=1S/C15H21FN2O/c1-11-3-4-12(2)14(9-11)17-15(19)10-18-7-5-13(16)6-8-18/h3-4,9,13H,5-8,10H2,1-2H3,(H,17,19)
InChIKeyIKXFBTYVYUWGMF-UHFFFAOYSA-N
MW264.34 g/mol
LogP2.68
Rot. Bonds3

About N-(2,5-dimethylphenyl)-2-(4-fluoropiperidin-1-yl)acetamide

N-(2,5-dimethylphenyl)-2-(4-fluoropiperidin-1-yl)acetamide (PubChem CID 171701345) has the molecular formula C15H21FN2O and a molecular weight of 264.34 g/mol. Its IUPAC name is N-(2,5-dimethylphenyl)-2-(4-fluoropiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2,5-dimethylphenyl)-2-(4-fluoropiperidin-1-yl)acetamide
PubChem CID171701345
Molecular FormulaC15H21FN2O
Molecular Weight264.34 g/mol
Exact Mass264.16
IUPAC NameN-(2,5-dimethylphenyl)-2-(4-fluoropiperidin-1-yl)acetamide
SMILESCc1ccc(C)c(NC(=O)CN2CCC(F)CC2)c1
InChIInChI=1S/C15H21FN2O/c1-11-3-4-12(2)14(9-11)17-15(19)10-18-7-5-13(16)6-8-18/h3-4,9,13H,5-8,10H2,1-2H3,(H,17,19)
InChIKeyIKXFBTYVYUWGMF-UHFFFAOYSA-N
XLogP2.68
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.34
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,5-dimethylphenyl)-2-pyrrolidin-1-ylacetamide
CID 8901854
2-(3-aminopyrrolidin-1-yl)-N-(2,5-dimethylphenyl)acetamide
CID 62068769
N-(2,5-dimethylphenyl)-2-[4-(oxolan-3-yl)piperazin-1-yl]acetamide
CID 71913541
2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-(2,5-dimethylphenyl)acetamide;hydrochloride
CID 119926850
N-(2,5-dimethylphenyl)-2-(4-propylpiperazin-1-yl)acetamide
CID 22196969
N-(2,5-dimethylphenyl)-2-(3-hydroxyazetidin-1-yl)acetamide
CID 63282334
2-(4-amino-3-methylpiperidin-1-yl)-N-(2,5-dimethylphenyl)acetamide
CID 79868364
2-(5,6-dimethyl-1,3-dihydroisoindol-2-yl)-N-(2,5-dimethylphenyl)acetamide
CID 126212920
N-(2,5-dimethylphenyl)-2-[4-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]piperazin-1-yl]acetamide
CID 30663123
N-(2,5-dimethylphenyl)-2-(2-methylmorpholin-4-yl)acetamide
CID 51291532
2-(4-aminopiperidin-1-yl)-N-(5-cyano-2-methylphenyl)acetamide
CID 79327658
2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-N-(5-fluoro-2-methylphenyl)acetamide
CID 1448805

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylphenyl)-2-(4-fluoropiperidin-1-yl)acetamide?
The IUPAC name of N-(2,5-dimethylphenyl)-2-(4-fluoropiperidin-1-yl)acetamide (CID 171701345) is N-(2,5-dimethylphenyl)-2-(4-fluoropiperidin-1-yl)acetamide.
What is the SMILES notation for N-(2,5-dimethylphenyl)-2-(4-fluoropiperidin-1-yl)acetamide?
The canonical SMILES for N-(2,5-dimethylphenyl)-2-(4-fluoropiperidin-1-yl)acetamide is Cc1ccc(C)c(NC(=O)CN2CCC(F)CC2)c1.
What is the InChIKey of N-(2,5-dimethylphenyl)-2-(4-fluoropiperidin-1-yl)acetamide?
The InChIKey is IKXFBTYVYUWGMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O/c1-11-3-4-12(2)14(9-11)17-15(19)10-18-7-5-13(16)6-8-18/h3-4,9,13H,5-8,10H2,1-2H3,(H,17,19).
What are the key properties of N-(2,5-dimethylphenyl)-2-(4-fluoropiperidin-1-yl)acetamide?
N-(2,5-dimethylphenyl)-2-(4-fluoropiperidin-1-yl)acetamide has a molecular weight of 264.34 g/mol, XLogP of 2.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylphenyl)-2-(4-fluoropiperidin-1-yl)acetamide is sourced from PubChem (CID 171701345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).