2,3-dimethoxy-N-methyl-N-piperidin-3-ylbenzamide

C15H22N2O3 — CID 60807050

IUPAC2,3-dimethoxy-N-methyl-N-piperidin-3-ylbenzamide
SMILESCOc1cccc(C(=O)N(C)C2CCCNC2)c1OC
InChIInChI=1S/C15H22N2O3/c1-17(11-6-5-9-16-10-11)15(18)12-7-4-8-13(19-2)14(12)20-3/h4,7-8,11,16H,5-6,9-10H2,1-3H3
InChIKeyQRCAYNKVGIJGEY-UHFFFAOYSA-N
MW278.35 g/mol
LogP1.53
Rot. Bonds4

About 2,3-dimethoxy-N-methyl-N-piperidin-3-ylbenzamide

2,3-dimethoxy-N-methyl-N-piperidin-3-ylbenzamide (PubChem CID 60807050) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is 2,3-dimethoxy-N-methyl-N-piperidin-3-ylbenzamide.

Molecular Properties

Compound Name2,3-dimethoxy-N-methyl-N-piperidin-3-ylbenzamide
PubChem CID60807050
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name2,3-dimethoxy-N-methyl-N-piperidin-3-ylbenzamide
SMILESCOc1cccc(C(=O)N(C)C2CCCNC2)c1OC
InChIInChI=1S/C15H22N2O3/c1-17(11-6-5-9-16-10-11)15(18)12-7-4-8-13(19-2)14(12)20-3/h4,7-8,11,16H,5-6,9-10H2,1-3H3
InChIKeyQRCAYNKVGIJGEY-UHFFFAOYSA-N
XLogP1.53
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-hydroxy-3-methoxy-N-methyl-N-pyrrolidin-3-ylbenzamide
CID 55026964
4-methoxy-N-methyl-N-pyrrolidin-3-ylnaphthalene-1-carboxamide;hydrochloride
CID 119552054
4-bromo-2-methoxy-N-methyl-N-piperidin-3-ylbenzamide
CID 115369622
N,2,3-trimethyl-N-piperidin-3-ylbenzamide
CID 54923746
N-ethyl-2-hydroxy-3-methoxy-N-piperidin-3-ylbenzamide
CID 60807403
2-methoxy-N-methyl-N-piperidin-4-ylbenzamide
CID 43602173
N-cyclohexyl-N-ethyl-2,3-dimethoxybenzamide
CID 134010441
2,6-difluoro-N-methyl-N-piperidin-3-ylbenzamide
CID 60806728
5-fluoro-N,2-dimethyl-N-piperidin-3-ylbenzamide
CID 55228435
N-(azepan-4-yl)-2-fluoro-6-methoxy-N-methylbenzamide
CID 107172410
3,5-dimethoxy-N-methyl-N-piperidin-3-ylbenzamide
CID 60807213
2-bromo-4-fluoro-N-methyl-N-piperidin-3-ylbenzamide
CID 63641753

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethoxy-N-methyl-N-piperidin-3-ylbenzamide?
The IUPAC name of 2,3-dimethoxy-N-methyl-N-piperidin-3-ylbenzamide (CID 60807050) is 2,3-dimethoxy-N-methyl-N-piperidin-3-ylbenzamide.
What is the SMILES notation for 2,3-dimethoxy-N-methyl-N-piperidin-3-ylbenzamide?
The canonical SMILES for 2,3-dimethoxy-N-methyl-N-piperidin-3-ylbenzamide is COc1cccc(C(=O)N(C)C2CCCNC2)c1OC.
What is the InChIKey of 2,3-dimethoxy-N-methyl-N-piperidin-3-ylbenzamide?
The InChIKey is QRCAYNKVGIJGEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-17(11-6-5-9-16-10-11)15(18)12-7-4-8-13(19-2)14(12)20-3/h4,7-8,11,16H,5-6,9-10H2,1-3H3.
What are the key properties of 2,3-dimethoxy-N-methyl-N-piperidin-3-ylbenzamide?
2,3-dimethoxy-N-methyl-N-piperidin-3-ylbenzamide has a molecular weight of 278.35 g/mol, XLogP of 1.53, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethoxy-N-methyl-N-piperidin-3-ylbenzamide is sourced from PubChem (CID 60807050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).