2-[4-methyl-4-(methylamino)piperidin-1-yl]-N-(4-methylphenyl)acetamide

C16H25N3O — CID 115305331

IUPAC2-[4-methyl-4-(methylamino)piperidin-1-yl]-N-(4-methylphenyl)acetamide
SMILESCNC1(C)CCN(CC(=O)Nc2ccc(C)cc2)CC1
InChIInChI=1S/C16H25N3O/c1-13-4-6-14(7-5-13)18-15(20)12-19-10-8-16(2,17-3)9-11-19/h4-7,17H,8-12H2,1-3H3,(H,18,20)
InChIKeyMQIFUTBHPULXTL-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.01
Rot. Bonds4

About 2-[4-methyl-4-(methylamino)piperidin-1-yl]-N-(4-methylphenyl)acetamide

2-[4-methyl-4-(methylamino)piperidin-1-yl]-N-(4-methylphenyl)acetamide (PubChem CID 115305331) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is 2-[4-methyl-4-(methylamino)piperidin-1-yl]-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[4-methyl-4-(methylamino)piperidin-1-yl]-N-(4-methylphenyl)acetamide
PubChem CID115305331
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC Name2-[4-methyl-4-(methylamino)piperidin-1-yl]-N-(4-methylphenyl)acetamide
SMILESCNC1(C)CCN(CC(=O)Nc2ccc(C)cc2)CC1
InChIInChI=1S/C16H25N3O/c1-13-4-6-14(7-5-13)18-15(20)12-19-10-8-16(2,17-3)9-11-19/h4-7,17H,8-12H2,1-3H3,(H,18,20)
InChIKeyMQIFUTBHPULXTL-UHFFFAOYSA-N
XLogP2.01
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,4-dichlorophenyl)-2-[4-methyl-4-(methylamino)piperidin-1-yl]acetamide
CID 115305044
2-(3-hydroxy-3-methylpyrrolidin-1-yl)-N-(4-methylphenyl)acetamide
CID 103728385
N-(3-chlorophenyl)-2-[4-methyl-4-(methylamino)piperidin-1-yl]acetamide
CID 115304932
N-(4-iodo-2-methylphenyl)-2-[4-methyl-4-(methylamino)piperidin-1-yl]acetamide
CID 115305243
2-(4-acetylpiperazin-1-yl)-N-(4-methylphenyl)acetamide
CID 2697560
N-(2-bromophenyl)-2-[4-methyl-4-(methylamino)piperidin-1-yl]acetamide
CID 115305227
N-(5-bromo-2-pyridinyl)-2-[4-methyl-4-(methylamino)piperidin-1-yl]acetamide
CID 115305446
2-[4-methoxy-4-(trifluoromethyl)piperidin-1-yl]-N-(4-methylphenyl)acetamide
CID 171337818
ethane;N-(4-methylphenyl)-2-morpholin-4-ylacetamide
CID 142923820
N-(4-methylphenyl)-2-(4-propylpiperazin-1-yl)acetamide
CID 22196968
N-(4-methylphenyl)-2-[4-[(4-methylphenyl)methyl]piperazin-1-yl]acetamide
CID 22194960
2-(4-hydroxy-4-methylpiperidin-1-yl)-N-(4-methoxyphenyl)acetamide
CID 80702513

Frequently Asked Questions

What is the IUPAC name of 2-[4-methyl-4-(methylamino)piperidin-1-yl]-N-(4-methylphenyl)acetamide?
The IUPAC name of 2-[4-methyl-4-(methylamino)piperidin-1-yl]-N-(4-methylphenyl)acetamide (CID 115305331) is 2-[4-methyl-4-(methylamino)piperidin-1-yl]-N-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-[4-methyl-4-(methylamino)piperidin-1-yl]-N-(4-methylphenyl)acetamide?
The canonical SMILES for 2-[4-methyl-4-(methylamino)piperidin-1-yl]-N-(4-methylphenyl)acetamide is CNC1(C)CCN(CC(=O)Nc2ccc(C)cc2)CC1.
What is the InChIKey of 2-[4-methyl-4-(methylamino)piperidin-1-yl]-N-(4-methylphenyl)acetamide?
The InChIKey is MQIFUTBHPULXTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-13-4-6-14(7-5-13)18-15(20)12-19-10-8-16(2,17-3)9-11-19/h4-7,17H,8-12H2,1-3H3,(H,18,20).
What are the key properties of 2-[4-methyl-4-(methylamino)piperidin-1-yl]-N-(4-methylphenyl)acetamide?
2-[4-methyl-4-(methylamino)piperidin-1-yl]-N-(4-methylphenyl)acetamide has a molecular weight of 275.40 g/mol, XLogP of 2.01, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-methyl-4-(methylamino)piperidin-1-yl]-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 115305331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).