3,5-dimethoxy-N-(2-methoxy-5-piperidin-1-ylphenyl)benzamide

C21H26N2O4 — CID 110359680

IUPAC3,5-dimethoxy-N-(2-methoxy-5-piperidin-1-ylphenyl)benzamide
SMILESCOc1cc(OC)cc(C(=O)Nc2cc(N3CCCCC3)ccc2OC)c1
InChIInChI=1S/C21H26N2O4/c1-25-17-11-15(12-18(14-17)26-2)21(24)22-19-13-16(7-8-20(19)27-3)23-9-5-4-6-10-23/h7-8,11-14H,4-6,9-10H2,1-3H3,(H,22,24)
InChIKeyQUFDEXUPYVGRBZ-UHFFFAOYSA-N
MW370.45 g/mol
LogP3.95
Rot. Bonds6

About 3,5-dimethoxy-N-(2-methoxy-5-piperidin-1-ylphenyl)benzamide

3,5-dimethoxy-N-(2-methoxy-5-piperidin-1-ylphenyl)benzamide (PubChem CID 110359680) has the molecular formula C21H26N2O4 and a molecular weight of 370.45 g/mol. Its IUPAC name is 3,5-dimethoxy-N-(2-methoxy-5-piperidin-1-ylphenyl)benzamide.

Molecular Properties

Compound Name3,5-dimethoxy-N-(2-methoxy-5-piperidin-1-ylphenyl)benzamide
PubChem CID110359680
Molecular FormulaC21H26N2O4
Molecular Weight370.45 g/mol
Exact Mass370.19
IUPAC Name3,5-dimethoxy-N-(2-methoxy-5-piperidin-1-ylphenyl)benzamide
SMILESCOc1cc(OC)cc(C(=O)Nc2cc(N3CCCCC3)ccc2OC)c1
InChIInChI=1S/C21H26N2O4/c1-25-17-11-15(12-18(14-17)26-2)21(24)22-19-13-16(7-8-20(19)27-3)23-9-5-4-6-10-23/h7-8,11-14H,4-6,9-10H2,1-3H3,(H,22,24)
InChIKeyQUFDEXUPYVGRBZ-UHFFFAOYSA-N
XLogP3.95
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

N-(2-fluoro-5-piperidin-1-ylphenyl)-3,4,5-trimethoxybenzamide
CID 110362244
N-(2-methoxy-5-piperidin-1-ylphenyl)cyclobutanecarboxamide
CID 110426214
3,4,5-trimethoxy-N-(2-methyl-5-pyrrolidin-1-ylphenyl)benzamide
CID 110361706
N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3,4-dimethoxybenzamide
CID 110361803
N-(2-chloro-5-pyrrolidin-1-ylphenyl)-4-methoxybenzamide
CID 110361913
N-(2-methoxy-5-pyrrolidin-1-ylphenyl)oxolane-2-carboxamide
CID 110361978
N-(2,5-dimethoxyphenyl)-2-piperidin-1-ylpyrimidine-5-carboxamide
CID 109250215
N-(2-methoxy-5-piperidin-1-ylphenyl)pentanamide
CID 110359665
2-cyclopropyl-N-(2-methoxy-5-piperidin-1-ylphenyl)propanamide
CID 110613175
N-(2-methoxy-5-methylphenyl)-5-piperidin-1-ylpyridine-3-carboxamide
CID 109226569
3,5-dimethoxy-N-[2-pyrrolidin-1-yl-5-(tetrazol-1-yl)phenyl]benzamide
CID 50776801
N'-(2,5-dimethoxyphenyl)-N-(4-pyrrolidin-1-ylphenyl)oxamide
CID 108987415

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-N-(2-methoxy-5-piperidin-1-ylphenyl)benzamide?
The IUPAC name of 3,5-dimethoxy-N-(2-methoxy-5-piperidin-1-ylphenyl)benzamide (CID 110359680) is 3,5-dimethoxy-N-(2-methoxy-5-piperidin-1-ylphenyl)benzamide.
What is the SMILES notation for 3,5-dimethoxy-N-(2-methoxy-5-piperidin-1-ylphenyl)benzamide?
The canonical SMILES for 3,5-dimethoxy-N-(2-methoxy-5-piperidin-1-ylphenyl)benzamide is COc1cc(OC)cc(C(=O)Nc2cc(N3CCCCC3)ccc2OC)c1.
What is the InChIKey of 3,5-dimethoxy-N-(2-methoxy-5-piperidin-1-ylphenyl)benzamide?
The InChIKey is QUFDEXUPYVGRBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O4/c1-25-17-11-15(12-18(14-17)26-2)21(24)22-19-13-16(7-8-20(19)27-3)23-9-5-4-6-10-23/h7-8,11-14H,4-6,9-10H2,1-3H3,(H,22,24).
What are the key properties of 3,5-dimethoxy-N-(2-methoxy-5-piperidin-1-ylphenyl)benzamide?
3,5-dimethoxy-N-(2-methoxy-5-piperidin-1-ylphenyl)benzamide has a molecular weight of 370.45 g/mol, XLogP of 3.95, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxy-N-(2-methoxy-5-piperidin-1-ylphenyl)benzamide is sourced from PubChem (CID 110359680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).