N-[6-[(3,4-dimethoxybenzoyl)amino]-2-pyridinyl]-3,4-dimethoxybenzamide

C23H23N3O6 — CID 1293762

IUPACN-[6-[(3,4-dimethoxybenzoyl)amino]-2-pyridinyl]-3,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cccc(NC(=O)c3ccc(OC)c(OC)c3)n2)cc1OC
InChIInChI=1S/C23H23N3O6/c1-29-16-10-8-14(12-18(16)31-3)22(27)25-20-6-5-7-21(24-20)26-23(28)15-9-11-17(30-2)19(13-15)32-4/h5-13H,1-4H3,(H2,24,25,26,27,28)
InChIKeyOBXGFAOTEHBATK-UHFFFAOYSA-N
MW437.45 g/mol
LogP3.62
Rot. Bonds8

About N-[6-[(3,4-dimethoxybenzoyl)amino]-2-pyridinyl]-3,4-dimethoxybenzamide

N-[6-[(3,4-dimethoxybenzoyl)amino]-2-pyridinyl]-3,4-dimethoxybenzamide (PubChem CID 1293762) has the molecular formula C23H23N3O6 and a molecular weight of 437.45 g/mol. Its IUPAC name is N-[6-[(3,4-dimethoxybenzoyl)amino]-2-pyridinyl]-3,4-dimethoxybenzamide.

Molecular Properties

Compound NameN-[6-[(3,4-dimethoxybenzoyl)amino]-2-pyridinyl]-3,4-dimethoxybenzamide
PubChem CID1293762
Molecular FormulaC23H23N3O6
Molecular Weight437.45 g/mol
Exact Mass437.16
IUPAC NameN-[6-[(3,4-dimethoxybenzoyl)amino]-2-pyridinyl]-3,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cccc(NC(=O)c3ccc(OC)c(OC)c3)n2)cc1OC
InChIInChI=1S/C23H23N3O6/c1-29-16-10-8-14(12-18(16)31-3)22(27)25-20-6-5-7-21(24-20)26-23(28)15-9-11-17(30-2)19(13-15)32-4/h5-13H,1-4H3,(H2,24,25,26,27,28)
InChIKeyOBXGFAOTEHBATK-UHFFFAOYSA-N
XLogP3.62
TPSA108.01 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.45
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-(2-Pyridinyl)-1,3-benzodioxole-5-carboxamide
CID 591105
N-(6-methylpyridin-2-yl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 708615
Ketone, 4-(2-pyridyl)piperazinyl 3,4,5-trimethoxyphenyl
CID 28761
4-Methoxy-N-(3-phenyl-isoquinolin-1-yl)-benzamide
CID 10760609
4-methoxy-N-pyridin-2-ylbenzamide
CID 821599
3,4-dimethoxy-N-(4-methyl-2-piperidin-1-ylquinolin-6-yl)benzamide
CID 12005317
3-methoxy-N-(6-methylpyridin-2-yl)benzamide
CID 585532
4-(Propan-2-yloxy)-N-(pyridin-2-YL)-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
CID 16015944
2-(3,4-dimethoxyphenyl)-N-(4-methyl-2-pyridinyl)acetamide
CID 762085
3,4,5-Trimethoxy-N-[2-[(2-pyridinylamino)carbonyl]phenyl]benzamide
CID 990988
N-(4-methylpyridin-2-yl)-1,3-benzodioxole-5-carboxamide
CID 1116221
4-Methoxy-N-(5-phenylacetylamino-pyridin-2-yl)-benzamide
CID 1452908

Frequently Asked Questions

What is the IUPAC name of N-[6-[(3,4-dimethoxybenzoyl)amino]-2-pyridinyl]-3,4-dimethoxybenzamide?
The IUPAC name of N-[6-[(3,4-dimethoxybenzoyl)amino]-2-pyridinyl]-3,4-dimethoxybenzamide (CID 1293762) is N-[6-[(3,4-dimethoxybenzoyl)amino]-2-pyridinyl]-3,4-dimethoxybenzamide.
What is the SMILES notation for N-[6-[(3,4-dimethoxybenzoyl)amino]-2-pyridinyl]-3,4-dimethoxybenzamide?
The canonical SMILES for N-[6-[(3,4-dimethoxybenzoyl)amino]-2-pyridinyl]-3,4-dimethoxybenzamide is COc1ccc(C(=O)Nc2cccc(NC(=O)c3ccc(OC)c(OC)c3)n2)cc1OC.
What is the InChIKey of N-[6-[(3,4-dimethoxybenzoyl)amino]-2-pyridinyl]-3,4-dimethoxybenzamide?
The InChIKey is OBXGFAOTEHBATK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O6/c1-29-16-10-8-14(12-18(16)31-3)22(27)25-20-6-5-7-21(24-20)26-23(28)15-9-11-17(30-2)19(13-15)32-4/h5-13H,1-4H3,(H2,24,25,26,27,28).
What are the key properties of N-[6-[(3,4-dimethoxybenzoyl)amino]-2-pyridinyl]-3,4-dimethoxybenzamide?
N-[6-[(3,4-dimethoxybenzoyl)amino]-2-pyridinyl]-3,4-dimethoxybenzamide has a molecular weight of 437.45 g/mol, XLogP of 3.62, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[(3,4-dimethoxybenzoyl)amino]-2-pyridinyl]-3,4-dimethoxybenzamide is sourced from PubChem (CID 1293762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).