N,N-dimethyl-4-(2-methylpiperidin-4-yl)benzamide;ethane

C17H28N2O — CID 177354214

IUPACN,N-dimethyl-4-(2-methylpiperidin-4-yl)benzamide;ethane
SMILESCC.CC1CC(c2ccc(C(=O)N(C)C)cc2)CCN1
InChIInChI=1S/C15H22N2O.C2H6/c1-11-10-14(8-9-16-11)12-4-6-13(7-5-12)15(18)17(2)3;1-2/h4-7,11,14,16H,8-10H2,1-3H3;1-2H3
InChIKeyLGPFZOMQMNKLHT-UHFFFAOYSA-N
MW276.42 g/mol
LogP3.27
Rot. Bonds2

About N,N-dimethyl-4-(2-methylpiperidin-4-yl)benzamide;ethane

N,N-dimethyl-4-(2-methylpiperidin-4-yl)benzamide;ethane (PubChem CID 177354214) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is N,N-dimethyl-4-(2-methylpiperidin-4-yl)benzamide;ethane.

Molecular Properties

Compound NameN,N-dimethyl-4-(2-methylpiperidin-4-yl)benzamide;ethane
PubChem CID177354214
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC NameN,N-dimethyl-4-(2-methylpiperidin-4-yl)benzamide;ethane
SMILESCC.CC1CC(c2ccc(C(=O)N(C)C)cc2)CCN1
InChIInChI=1S/C15H22N2O.C2H6/c1-11-10-14(8-9-16-11)12-4-6-13(7-5-12)15(18)17(2)3;1-2/h4-7,11,14,16H,8-10H2,1-3H3;1-2H3
InChIKeyLGPFZOMQMNKLHT-UHFFFAOYSA-N
XLogP3.27
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(4-cyclopropylphenoxy)-N,N-dimethylbenzamide
CID 142415331
4-(4-cyclopentylphenoxy)-N,N-dimethylbenzamide
CID 142415037
4-(3-fluoropiperidin-4-yl)-N,N-dimethylbenzamide
CID 177300842
N,N-dimethyl-4-[(1S,2R)-2-propan-2-ylcyclopropyl]benzamide
CID 166826538
3-N,3-N-dimethyl-1-N-(2-methylpiperidin-4-yl)benzene-1,3-dicarboxamide;hydrochloride
CID 120599313
N,N,3-trimethyl-4-piperidin-4-ylbenzamide
CID 70330604
N,N-dimethyl-4-(3-methylpiperazin-1-yl)sulfonylbenzamide
CID 120710435
N,N,2-trimethyl-4-piperidin-4-ylbenzamide;hydrochloride
CID 169452615
2-[[4-(dimethylcarbamoyl)phenyl]methylcarbamoyl]cyclobutane-1-carboxylic acid
CID 120974686
N,N-dimethyl-4-[[(5-methyl-4,5-dihydro-1H-imidazol-2-yl)amino]methyl]benzamide;hydroiodide
CID 120969436
N,N,2-trimethyl-1,2,3,4-tetrahydroquinoline-6-carboxamide
CID 102567770
ethane;2-methyl-4-phenylpyrrolidine
CID 176952755

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(2-methylpiperidin-4-yl)benzamide;ethane?
The IUPAC name of N,N-dimethyl-4-(2-methylpiperidin-4-yl)benzamide;ethane (CID 177354214) is N,N-dimethyl-4-(2-methylpiperidin-4-yl)benzamide;ethane.
What is the SMILES notation for N,N-dimethyl-4-(2-methylpiperidin-4-yl)benzamide;ethane?
The canonical SMILES for N,N-dimethyl-4-(2-methylpiperidin-4-yl)benzamide;ethane is CC.CC1CC(c2ccc(C(=O)N(C)C)cc2)CCN1.
What is the InChIKey of N,N-dimethyl-4-(2-methylpiperidin-4-yl)benzamide;ethane?
The InChIKey is LGPFZOMQMNKLHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O.C2H6/c1-11-10-14(8-9-16-11)12-4-6-13(7-5-12)15(18)17(2)3;1-2/h4-7,11,14,16H,8-10H2,1-3H3;1-2H3.
What are the key properties of N,N-dimethyl-4-(2-methylpiperidin-4-yl)benzamide;ethane?
N,N-dimethyl-4-(2-methylpiperidin-4-yl)benzamide;ethane has a molecular weight of 276.42 g/mol, XLogP of 3.27, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-(2-methylpiperidin-4-yl)benzamide;ethane is sourced from PubChem (CID 177354214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).