N-(3,4-dimethoxyphenyl)-2-(2,6-dimethylpiperidin-1-yl)acetamide

C17H26N2O3 — CID 78843301

IUPACN-(3,4-dimethoxyphenyl)-2-(2,6-dimethylpiperidin-1-yl)acetamide
SMILESCOc1ccc(NC(=O)CN2C(C)CCCC2C)cc1OC
InChIInChI=1S/C17H26N2O3/c1-12-6-5-7-13(2)19(12)11-17(20)18-14-8-9-15(21-3)16(10-14)22-4/h8-10,12-13H,5-7,11H2,1-4H3,(H,18,20)
InChIKeyLGACFRMEXMUQJR-UHFFFAOYSA-N
MW306.41 g/mol
LogP2.91
Rot. Bonds5

About N-(3,4-dimethoxyphenyl)-2-(2,6-dimethylpiperidin-1-yl)acetamide

N-(3,4-dimethoxyphenyl)-2-(2,6-dimethylpiperidin-1-yl)acetamide (PubChem CID 78843301) has the molecular formula C17H26N2O3 and a molecular weight of 306.41 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-2-(2,6-dimethylpiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-2-(2,6-dimethylpiperidin-1-yl)acetamide
PubChem CID78843301
Molecular FormulaC17H26N2O3
Molecular Weight306.41 g/mol
Exact Mass306.19
IUPAC NameN-(3,4-dimethoxyphenyl)-2-(2,6-dimethylpiperidin-1-yl)acetamide
SMILESCOc1ccc(NC(=O)CN2C(C)CCCC2C)cc1OC
InChIInChI=1S/C17H26N2O3/c1-12-6-5-7-13(2)19(12)11-17(20)18-14-8-9-15(21-3)16(10-14)22-4/h8-10,12-13H,5-7,11H2,1-4H3,(H,18,20)
InChIKeyLGACFRMEXMUQJR-UHFFFAOYSA-N
XLogP2.91
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-amino-2-methoxyphenyl)-2-(2,6-dimethylpiperidin-1-yl)acetamide
CID 16782750
2-[(2R)-2-(3,4-dimethoxyphenyl)-6-methylpiperidin-1-yl]-N-[3-(trifluoromethyl)phenyl]acetamide
CID 143179483
2-(4-aminopiperidin-1-yl)-N-(3,4-dimethoxyphenyl)acetamide
CID 79322239
N-(3,4-dimethoxyphenyl)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]acetamide
CID 8930671
N-(3-amino-4-chlorophenyl)-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]acetamide
CID 30111948
2-cyclopentyl-N-(3,4-dimethoxyphenyl)acetamide
CID 2682853
N-(3,4-dimethoxyphenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide
CID 119920227
N,N'-bis(3,4-dimethoxyphenyl)propanediamide
CID 21232287
(2S)-N-(3,4-dimethoxyphenyl)-2-methylpiperidine-1-carboxamide
CID 1474768
2-[acetyl(cyclopentyl)amino]-N-(3,4-dimethoxyphenyl)acetamide
CID 113159345
N-(3,4-dimethoxyphenyl)-3-(4-methylpiperidin-1-yl)-3-oxopropanamide
CID 108942812
1-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-N-methylpiperidine-4-carboxamide
CID 16909656

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-2-(2,6-dimethylpiperidin-1-yl)acetamide?
The IUPAC name of N-(3,4-dimethoxyphenyl)-2-(2,6-dimethylpiperidin-1-yl)acetamide (CID 78843301) is N-(3,4-dimethoxyphenyl)-2-(2,6-dimethylpiperidin-1-yl)acetamide.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-2-(2,6-dimethylpiperidin-1-yl)acetamide?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-2-(2,6-dimethylpiperidin-1-yl)acetamide is COc1ccc(NC(=O)CN2C(C)CCCC2C)cc1OC.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-2-(2,6-dimethylpiperidin-1-yl)acetamide?
The InChIKey is LGACFRMEXMUQJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O3/c1-12-6-5-7-13(2)19(12)11-17(20)18-14-8-9-15(21-3)16(10-14)22-4/h8-10,12-13H,5-7,11H2,1-4H3,(H,18,20).
What are the key properties of N-(3,4-dimethoxyphenyl)-2-(2,6-dimethylpiperidin-1-yl)acetamide?
N-(3,4-dimethoxyphenyl)-2-(2,6-dimethylpiperidin-1-yl)acetamide has a molecular weight of 306.41 g/mol, XLogP of 2.91, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-2-(2,6-dimethylpiperidin-1-yl)acetamide is sourced from PubChem (CID 78843301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).