N-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-N-(1-methylpiperidin-2-yl)acetamide

C22H27FN2O2 — CID 91318413

IUPACN-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-N-(1-methylpiperidin-2-yl)acetamide
SMILESCOc1ccc(CC(=O)N(Cc2ccc(F)cc2)C2CCCCN2C)cc1
InChIInChI=1S/C22H27FN2O2/c1-24-14-4-3-5-21(24)25(16-18-6-10-19(23)11-7-18)22(26)15-17-8-12-20(27-2)13-9-17/h6-13,21H,3-5,14-16H2,1-2H3
InChIKeyYSLPOOCJINLLKW-UHFFFAOYSA-N
MW370.47 g/mol
LogP3.85
Rot. Bonds6

About N-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-N-(1-methylpiperidin-2-yl)acetamide

N-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-N-(1-methylpiperidin-2-yl)acetamide (PubChem CID 91318413) has the molecular formula C22H27FN2O2 and a molecular weight of 370.47 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-N-(1-methylpiperidin-2-yl)acetamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-N-(1-methylpiperidin-2-yl)acetamide
PubChem CID91318413
Molecular FormulaC22H27FN2O2
Molecular Weight370.47 g/mol
Exact Mass370.21
IUPAC NameN-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-N-(1-methylpiperidin-2-yl)acetamide
SMILESCOc1ccc(CC(=O)N(Cc2ccc(F)cc2)C2CCCCN2C)cc1
InChIInChI=1S/C22H27FN2O2/c1-24-14-4-3-5-21(24)25(16-18-6-10-19(23)11-7-18)22(26)15-17-8-12-20(27-2)13-9-17/h6-13,21H,3-5,14-16H2,1-2H3
InChIKeyYSLPOOCJINLLKW-UHFFFAOYSA-N
XLogP3.85
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.47
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-chlorophenyl)methyl]-2-(4-methoxyphenyl)-N-(1-propan-2-ylpiperidin-2-yl)acetamide
CID 91198671
2-(4-fluorophenyl)-N-[(4-methoxyphenyl)methyl]-N-methylacetamide
CID 94010767
N-[(4-chlorophenyl)methyl]-2-(4-methoxyphenyl)-N-[1-(2,2,2-trifluoroacetyl)piperidin-4-yl]acetamide
CID 23512961
N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 9299632
N-cyclohexyl-2-[[2-(4-fluorophenyl)acetyl]-[(4-methoxyphenyl)methyl]amino]butanamide
CID 132611760
(2S)-N-cyclohexyl-2-[(4-fluorophenyl)methyl-[2-(4-methoxyphenyl)acetyl]amino]butanamide
CID 100567970
N-cyclopropyl-N-[(4-fluorophenyl)methyl]-2-(4-methylphenyl)acetamide
CID 78814100
2-[2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]-2-oxoethyl]sulfanyl-N-(4-fluorophenyl)acetamide
CID 9298853
N-(2-chloroethyl)-N-cyclohexyl-2-(4-methoxyphenyl)acetamide
CID 63391425
N-cyclopentyl-N-ethyl-2-(4-fluorophenyl)acetamide
CID 86926966
1-cyclopropyl-1-[(4-fluorophenyl)methyl]-3-(4-methoxyphenyl)urea
CID 30938797
N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 31425201

Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-N-(1-methylpiperidin-2-yl)acetamide?
The IUPAC name of N-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-N-(1-methylpiperidin-2-yl)acetamide (CID 91318413) is N-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-N-(1-methylpiperidin-2-yl)acetamide.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-N-(1-methylpiperidin-2-yl)acetamide?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-N-(1-methylpiperidin-2-yl)acetamide is COc1ccc(CC(=O)N(Cc2ccc(F)cc2)C2CCCCN2C)cc1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-N-(1-methylpiperidin-2-yl)acetamide?
The InChIKey is YSLPOOCJINLLKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27FN2O2/c1-24-14-4-3-5-21(24)25(16-18-6-10-19(23)11-7-18)22(26)15-17-8-12-20(27-2)13-9-17/h6-13,21H,3-5,14-16H2,1-2H3.
What are the key properties of N-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-N-(1-methylpiperidin-2-yl)acetamide?
N-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-N-(1-methylpiperidin-2-yl)acetamide has a molecular weight of 370.47 g/mol, XLogP of 3.85, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-N-(1-methylpiperidin-2-yl)acetamide is sourced from PubChem (CID 91318413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).