2-(3,5-dimethylpiperidin-1-yl)-N-(3-methylphenyl)acetamide

C16H24N2O — CID 22198013

IUPAC2-(3,5-dimethylpiperidin-1-yl)-N-(3-methylphenyl)acetamide
SMILESCc1cccc(NC(=O)CN2CC(C)CC(C)C2)c1
InChIInChI=1S/C16H24N2O/c1-12-5-4-6-15(8-12)17-16(19)11-18-9-13(2)7-14(3)10-18/h4-6,8,13-14H,7,9-11H2,1-3H3,(H,17,19)
InChIKeyNASFFHFPIMADLT-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.91
Rot. Bonds3

About 2-(3,5-dimethylpiperidin-1-yl)-N-(3-methylphenyl)acetamide

2-(3,5-dimethylpiperidin-1-yl)-N-(3-methylphenyl)acetamide (PubChem CID 22198013) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-(3,5-dimethylpiperidin-1-yl)-N-(3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(3,5-dimethylpiperidin-1-yl)-N-(3-methylphenyl)acetamide
PubChem CID22198013
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-(3,5-dimethylpiperidin-1-yl)-N-(3-methylphenyl)acetamide
SMILESCc1cccc(NC(=O)CN2CC(C)CC(C)C2)c1
InChIInChI=1S/C16H24N2O/c1-12-5-4-6-15(8-12)17-16(19)11-18-9-13(2)7-14(3)10-18/h4-6,8,13-14H,7,9-11H2,1-3H3,(H,17,19)
InChIKeyNASFFHFPIMADLT-UHFFFAOYSA-N
XLogP2.91
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-N-(3-methylphenyl)acetamide
CID 155981782
2-(azocan-1-yl)-N-(3-methylphenyl)acetamide
CID 2655272
N-cyclopropyl-1-[2-(3-methylanilino)-2-oxoethyl]azetidine-3-carboxamide
CID 171327777
N-[3-(diethylsulfamoyl)phenyl]-2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]acetamide
CID 8930625
2-[(3R)-3-hydroxypiperidin-1-yl]-N-(3-methylphenyl)acetamide
CID 129367068
N-(3-methylphenyl)-2-(3-piperazin-1-ylazetidin-1-yl)acetamide
CID 66197537
4-[2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-oxoethyl]-N-(3-methylphenyl)piperazine-1-carboxamide
CID 25437306
N-(3,4-dimethoxyphenyl)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]acetamide
CID 8930671
2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N-(2,4,6-trimethylphenyl)acetamide
CID 8930661
2-[(3S,5R)-3,5-dimethylpiperidin-1-yl]-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide
CID 8930825
N-(3-methylphenyl)-3-[(3R)-3-methylpiperidin-1-yl]propanamide
CID 739962
2-[4-(aminomethyl)-2-methylpyrrolidin-1-yl]-N-(3-methylphenyl)acetamide
CID 115486471

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylpiperidin-1-yl)-N-(3-methylphenyl)acetamide?
The IUPAC name of 2-(3,5-dimethylpiperidin-1-yl)-N-(3-methylphenyl)acetamide (CID 22198013) is 2-(3,5-dimethylpiperidin-1-yl)-N-(3-methylphenyl)acetamide.
What is the SMILES notation for 2-(3,5-dimethylpiperidin-1-yl)-N-(3-methylphenyl)acetamide?
The canonical SMILES for 2-(3,5-dimethylpiperidin-1-yl)-N-(3-methylphenyl)acetamide is Cc1cccc(NC(=O)CN2CC(C)CC(C)C2)c1.
What is the InChIKey of 2-(3,5-dimethylpiperidin-1-yl)-N-(3-methylphenyl)acetamide?
The InChIKey is NASFFHFPIMADLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-12-5-4-6-15(8-12)17-16(19)11-18-9-13(2)7-14(3)10-18/h4-6,8,13-14H,7,9-11H2,1-3H3,(H,17,19).
What are the key properties of 2-(3,5-dimethylpiperidin-1-yl)-N-(3-methylphenyl)acetamide?
2-(3,5-dimethylpiperidin-1-yl)-N-(3-methylphenyl)acetamide has a molecular weight of 260.38 g/mol, XLogP of 2.91, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylpiperidin-1-yl)-N-(3-methylphenyl)acetamide is sourced from PubChem (CID 22198013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).