2,6-dimethoxy-N-[1-(pyridine-3-carbonyl)piperidin-4-yl]benzamide

C20H23N3O4 — CID 108549740

IUPAC2,6-dimethoxy-N-[1-(pyridine-3-carbonyl)piperidin-4-yl]benzamide
SMILESCOc1cccc(OC)c1C(=O)NC1CCN(C(=O)c2cccnc2)CC1
InChIInChI=1S/C20H23N3O4/c1-26-16-6-3-7-17(27-2)18(16)19(24)22-15-8-11-23(12-9-15)20(25)14-5-4-10-21-13-14/h3-7,10,13,15H,8-9,11-12H2,1-2H3,(H,22,24)
InChIKeyWXRHVCRXAIWRRA-UHFFFAOYSA-N
MW369.42 g/mol
LogP2.13
Rot. Bonds5

About 2,6-dimethoxy-N-[1-(pyridine-3-carbonyl)piperidin-4-yl]benzamide

2,6-dimethoxy-N-[1-(pyridine-3-carbonyl)piperidin-4-yl]benzamide (PubChem CID 108549740) has the molecular formula C20H23N3O4 and a molecular weight of 369.42 g/mol. Its IUPAC name is 2,6-dimethoxy-N-[1-(pyridine-3-carbonyl)piperidin-4-yl]benzamide.

Molecular Properties

Compound Name2,6-dimethoxy-N-[1-(pyridine-3-carbonyl)piperidin-4-yl]benzamide
PubChem CID108549740
Molecular FormulaC20H23N3O4
Molecular Weight369.42 g/mol
Exact Mass369.17
IUPAC Name2,6-dimethoxy-N-[1-(pyridine-3-carbonyl)piperidin-4-yl]benzamide
SMILESCOc1cccc(OC)c1C(=O)NC1CCN(C(=O)c2cccnc2)CC1
InChIInChI=1S/C20H23N3O4/c1-26-16-6-3-7-17(27-2)18(16)19(24)22-15-8-11-23(12-9-15)20(25)14-5-4-10-21-13-14/h3-7,10,13,15H,8-9,11-12H2,1-2H3,(H,22,24)
InChIKeyWXRHVCRXAIWRRA-UHFFFAOYSA-N
XLogP2.13
TPSA80.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.42
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]-2,6-dimethoxybenzamide
CID 108549752
[4-(2,6-dimethoxyphenoxy)piperidin-1-yl]-pyridin-3-ylmethanone
CID 56796144
2-chloro-N-[1-(pyridine-3-carbonyl)piperidin-4-yl]acetamide
CID 108563315
2-chloro-N-[1-(pyridine-3-carbonyl)piperidin-4-yl]propanamide
CID 108563311
2,6-dimethoxy-N-[1-(2-sulfanylbenzoyl)piperidin-4-yl]benzamide
CID 108549795
1-tert-butyl-3-[1-(pyridine-3-carbonyl)piperidin-4-yl]urea
CID 110821121
2-(2-ethylphenoxy)-N-[1-(pyridine-3-carbonyl)piperidin-4-yl]acetamide
CID 108557029
2-methoxy-N-[1-(3-methoxybenzoyl)piperidin-4-yl]benzamide
CID 108549181
N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]-3-fluorobenzamide
CID 108557453
2,6-dimethoxy-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzamide
CID 110712543
[3-[[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]carbamoyl]phenyl] acetate
CID 108548503
2,2-diphenyl-N-[1-(pyridine-3-carbonyl)piperidin-4-yl]acetamide
CID 108549584

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethoxy-N-[1-(pyridine-3-carbonyl)piperidin-4-yl]benzamide?
The IUPAC name of 2,6-dimethoxy-N-[1-(pyridine-3-carbonyl)piperidin-4-yl]benzamide (CID 108549740) is 2,6-dimethoxy-N-[1-(pyridine-3-carbonyl)piperidin-4-yl]benzamide.
What is the SMILES notation for 2,6-dimethoxy-N-[1-(pyridine-3-carbonyl)piperidin-4-yl]benzamide?
The canonical SMILES for 2,6-dimethoxy-N-[1-(pyridine-3-carbonyl)piperidin-4-yl]benzamide is COc1cccc(OC)c1C(=O)NC1CCN(C(=O)c2cccnc2)CC1.
What is the InChIKey of 2,6-dimethoxy-N-[1-(pyridine-3-carbonyl)piperidin-4-yl]benzamide?
The InChIKey is WXRHVCRXAIWRRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O4/c1-26-16-6-3-7-17(27-2)18(16)19(24)22-15-8-11-23(12-9-15)20(25)14-5-4-10-21-13-14/h3-7,10,13,15H,8-9,11-12H2,1-2H3,(H,22,24).
What are the key properties of 2,6-dimethoxy-N-[1-(pyridine-3-carbonyl)piperidin-4-yl]benzamide?
2,6-dimethoxy-N-[1-(pyridine-3-carbonyl)piperidin-4-yl]benzamide has a molecular weight of 369.42 g/mol, XLogP of 2.13, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethoxy-N-[1-(pyridine-3-carbonyl)piperidin-4-yl]benzamide is sourced from PubChem (CID 108549740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).