2,5-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide

C16H24N2O3 — CID 106627649

IUPAC2,5-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide
SMILESCOc1ccc(OC)c(C(=O)N(C)CC2CCCNC2)c1
InChIInChI=1S/C16H24N2O3/c1-18(11-12-5-4-8-17-10-12)16(19)14-9-13(20-2)6-7-15(14)21-3/h6-7,9,12,17H,4-5,8,10-11H2,1-3H3
InChIKeyMEDCIKSPBRIUTP-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.78
Rot. Bonds5

About 2,5-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide

2,5-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide (PubChem CID 106627649) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2,5-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide.

Molecular Properties

Compound Name2,5-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide
PubChem CID106627649
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2,5-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide
SMILESCOc1ccc(OC)c(C(=O)N(C)CC2CCCNC2)c1
InChIInChI=1S/C16H24N2O3/c1-18(11-12-5-4-8-17-10-12)16(19)14-9-13(20-2)6-7-15(14)21-3/h6-7,9,12,17H,4-5,8,10-11H2,1-3H3
InChIKeyMEDCIKSPBRIUTP-UHFFFAOYSA-N
XLogP1.78
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,5-dimethoxy-N-methyl-N-(piperidin-4-ylmethyl)benzamide
CID 79700189
1-(2,5-dimethoxyphenyl)-2-piperidin-3-ylethanone
CID 116564241
N-ethyl-2-methoxy-5-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 106629432
2-bromo-5-methoxy-N-methyl-N-(piperidin-4-ylmethyl)benzamide
CID 79715879
2-chloro-5-hydroxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 106627741
2-fluoro-N,5-dimethyl-N-(piperidin-3-ylmethyl)benzamide
CID 106628063
2,5-dimethoxy-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119551921
2,4-dibromo-N-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 107940298
5-fluoro-N,2-dimethyl-N-(piperidin-3-ylmethyl)benzamide
CID 106627610
2,4-dimethoxy-N-(2-piperidin-3-ylethyl)benzamide
CID 60894812
2-fluoro-N,3-dimethyl-N-(piperidin-3-ylmethyl)benzamide
CID 106627734
2,5-dimethoxy-N-(2-pyrrolidin-3-ylethyl)benzamide;hydrochloride
CID 119535388

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide?
The IUPAC name of 2,5-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide (CID 106627649) is 2,5-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide.
What is the SMILES notation for 2,5-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide?
The canonical SMILES for 2,5-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide is COc1ccc(OC)c(C(=O)N(C)CC2CCCNC2)c1.
What is the InChIKey of 2,5-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide?
The InChIKey is MEDCIKSPBRIUTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-18(11-12-5-4-8-17-10-12)16(19)14-9-13(20-2)6-7-15(14)21-3/h6-7,9,12,17H,4-5,8,10-11H2,1-3H3.
What are the key properties of 2,5-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide?
2,5-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide has a molecular weight of 292.38 g/mol, XLogP of 1.78, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)benzamide is sourced from PubChem (CID 106627649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).