N-(2,6-diethylphenyl)-2-(3-methylpiperidin-1-yl)acetamide

C18H28N2O — CID 22197765

IUPACN-(2,6-diethylphenyl)-2-(3-methylpiperidin-1-yl)acetamide
SMILESCCc1cccc(CC)c1NC(=O)CN1CCCC(C)C1
InChIInChI=1S/C18H28N2O/c1-4-15-9-6-10-16(5-2)18(15)19-17(21)13-20-11-7-8-14(3)12-20/h6,9-10,14H,4-5,7-8,11-13H2,1-3H3,(H,19,21)
InChIKeyGKCQETSJLLJHBO-UHFFFAOYSA-N
MW288.44 g/mol
LogP3.48
Rot. Bonds5

About N-(2,6-diethylphenyl)-2-(3-methylpiperidin-1-yl)acetamide

N-(2,6-diethylphenyl)-2-(3-methylpiperidin-1-yl)acetamide (PubChem CID 22197765) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is N-(2,6-diethylphenyl)-2-(3-methylpiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2,6-diethylphenyl)-2-(3-methylpiperidin-1-yl)acetamide
PubChem CID22197765
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC NameN-(2,6-diethylphenyl)-2-(3-methylpiperidin-1-yl)acetamide
SMILESCCc1cccc(CC)c1NC(=O)CN1CCCC(C)C1
InChIInChI=1S/C18H28N2O/c1-4-15-9-6-10-16(5-2)18(15)19-17(21)13-20-11-7-8-14(3)12-20/h6,9-10,14H,4-5,7-8,11-13H2,1-3H3,(H,19,21)
InChIKeyGKCQETSJLLJHBO-UHFFFAOYSA-N
XLogP3.48
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,6-diethylphenyl)-2-(4-methylpiperidin-1-yl)acetamide
CID 22197689
N-(2,6-diethylphenyl)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]acetamide
CID 8930429
N-[2,6-di(propan-2-yl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide
CID 2682066
N-(2,6-diethylphenyl)-2-(4-hydroxypiperidin-1-yl)acetamide
CID 51171911
2-[(3S)-3-methylpiperidin-1-yl]-N-(2,4,6-trimethylphenyl)acetamide
CID 2681954
N-(3-bromophenyl)-2-[(3S)-3-methylpiperidin-1-yl]acetamide
CID 2681799
N-(2-methylnaphthalen-1-yl)-2-[(3R)-3-methylpiperidin-1-yl]acetamide
CID 856171
2-(3-methylpiperidin-1-yl)-N-pyridin-4-ylacetamide
CID 17066608
N-[4-(aminomethyl)phenyl]-2-(3-methylpiperidin-1-yl)acetamide
CID 16779543
N-(2,6-dichloro-3-methylphenyl)-2-[(3S)-3-methylpiperidin-1-yl]acetamide
CID 2681882
N-benzhydryl-2-[(3R)-3-methylpiperidin-1-yl]acetamide
CID 2681889
N-(4-aminophenyl)-2-(3-methylpiperidin-1-yl)acetamide
CID 16779145

Frequently Asked Questions

What is the IUPAC name of N-(2,6-diethylphenyl)-2-(3-methylpiperidin-1-yl)acetamide?
The IUPAC name of N-(2,6-diethylphenyl)-2-(3-methylpiperidin-1-yl)acetamide (CID 22197765) is N-(2,6-diethylphenyl)-2-(3-methylpiperidin-1-yl)acetamide.
What is the SMILES notation for N-(2,6-diethylphenyl)-2-(3-methylpiperidin-1-yl)acetamide?
The canonical SMILES for N-(2,6-diethylphenyl)-2-(3-methylpiperidin-1-yl)acetamide is CCc1cccc(CC)c1NC(=O)CN1CCCC(C)C1.
What is the InChIKey of N-(2,6-diethylphenyl)-2-(3-methylpiperidin-1-yl)acetamide?
The InChIKey is GKCQETSJLLJHBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-4-15-9-6-10-16(5-2)18(15)19-17(21)13-20-11-7-8-14(3)12-20/h6,9-10,14H,4-5,7-8,11-13H2,1-3H3,(H,19,21).
What are the key properties of N-(2,6-diethylphenyl)-2-(3-methylpiperidin-1-yl)acetamide?
N-(2,6-diethylphenyl)-2-(3-methylpiperidin-1-yl)acetamide has a molecular weight of 288.44 g/mol, XLogP of 3.48, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-diethylphenyl)-2-(3-methylpiperidin-1-yl)acetamide is sourced from PubChem (CID 22197765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).