2-(4-fluoropiperidin-1-yl)-N-[(3-methoxyphenyl)methyl]acetamide

C15H21FN2O2 — CID 171701324

IUPAC2-(4-fluoropiperidin-1-yl)-N-[(3-methoxyphenyl)methyl]acetamide
SMILESCOc1cccc(CNC(=O)CN2CCC(F)CC2)c1
InChIInChI=1S/C15H21FN2O2/c1-20-14-4-2-3-12(9-14)10-17-15(19)11-18-7-5-13(16)6-8-18/h2-4,9,13H,5-8,10-11H2,1H3,(H,17,19)
InChIKeyCEKSGTLDEMDWDU-UHFFFAOYSA-N
MW280.34 g/mol
LogP1.75
Rot. Bonds5

About 2-(4-fluoropiperidin-1-yl)-N-[(3-methoxyphenyl)methyl]acetamide

2-(4-fluoropiperidin-1-yl)-N-[(3-methoxyphenyl)methyl]acetamide (PubChem CID 171701324) has the molecular formula C15H21FN2O2 and a molecular weight of 280.34 g/mol. Its IUPAC name is 2-(4-fluoropiperidin-1-yl)-N-[(3-methoxyphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-fluoropiperidin-1-yl)-N-[(3-methoxyphenyl)methyl]acetamide
PubChem CID171701324
Molecular FormulaC15H21FN2O2
Molecular Weight280.34 g/mol
Exact Mass280.16
IUPAC Name2-(4-fluoropiperidin-1-yl)-N-[(3-methoxyphenyl)methyl]acetamide
SMILESCOc1cccc(CNC(=O)CN2CCC(F)CC2)c1
InChIInChI=1S/C15H21FN2O2/c1-20-14-4-2-3-12(9-14)10-17-15(19)11-18-7-5-13(16)6-8-18/h2-4,9,13H,5-8,10-11H2,1H3,(H,17,19)
InChIKeyCEKSGTLDEMDWDU-UHFFFAOYSA-N
XLogP1.75
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.34
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(4-fluoropiperidin-1-yl)-N-[(3-methoxyphenyl)methyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-aminopiperidin-1-yl)-N-[(3-methoxyphenyl)methyl]acetamide;hydrochloride
CID 119907160
N-[(3-methoxyphenyl)methyl]-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide
CID 119922266
2-[3-(aminomethyl)pyrrolidin-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide
CID 62062896
N-[(3-methoxyphenyl)methyl]-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide;hydrochloride
CID 119921834
N-[(3-methoxyphenyl)methyl]-2-[4-(2-methylpyrazol-3-yl)piperidin-1-yl]acetamide
CID 51104314
N-benzyl-2-[4-[2-(3-methoxyanilino)-2-oxoethyl]piperazin-1-yl]acetamide
CID 29487815
2-(cyclopropylmethylamino)-N-[(3-methoxyphenyl)methyl]acetamide;hydrochloride
CID 119678219
2-[4-[(2-methoxy-5-methylphenyl)methyl]piperazin-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide
CID 8997331
2-(4-fluoropiperidin-1-yl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 171701323
N-(2-aminoethyl)-1-[2-[(3-methoxyphenyl)methylamino]-2-oxoethyl]piperidine-3-carboxamide
CID 119916676
N-[(3-methoxyphenyl)methyl]-2-(2-oxopyrrolidin-1-yl)acetamide
CID 47111335
1-[2-[(3-butoxyphenyl)methylamino]-2-oxoethyl]piperidine-4-carboxylic acid
CID 119907001

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoropiperidin-1-yl)-N-[(3-methoxyphenyl)methyl]acetamide?
The IUPAC name of 2-(4-fluoropiperidin-1-yl)-N-[(3-methoxyphenyl)methyl]acetamide (CID 171701324) is 2-(4-fluoropiperidin-1-yl)-N-[(3-methoxyphenyl)methyl]acetamide.
What is the SMILES notation for 2-(4-fluoropiperidin-1-yl)-N-[(3-methoxyphenyl)methyl]acetamide?
The canonical SMILES for 2-(4-fluoropiperidin-1-yl)-N-[(3-methoxyphenyl)methyl]acetamide is COc1cccc(CNC(=O)CN2CCC(F)CC2)c1.
What is the InChIKey of 2-(4-fluoropiperidin-1-yl)-N-[(3-methoxyphenyl)methyl]acetamide?
The InChIKey is CEKSGTLDEMDWDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O2/c1-20-14-4-2-3-12(9-14)10-17-15(19)11-18-7-5-13(16)6-8-18/h2-4,9,13H,5-8,10-11H2,1H3,(H,17,19).
What are the key properties of 2-(4-fluoropiperidin-1-yl)-N-[(3-methoxyphenyl)methyl]acetamide?
2-(4-fluoropiperidin-1-yl)-N-[(3-methoxyphenyl)methyl]acetamide has a molecular weight of 280.34 g/mol, XLogP of 1.75, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoropiperidin-1-yl)-N-[(3-methoxyphenyl)methyl]acetamide is sourced from PubChem (CID 171701324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).