N-[6-[(3,5-dimethoxybenzoyl)amino]-2-pyridinyl]-3,5-dimethoxybenzamide

C23H23N3O6 — CID 1035470

IUPACN-[6-[(3,5-dimethoxybenzoyl)amino]-2-pyridinyl]-3,5-dimethoxybenzamide
SMILESCOc1cc(OC)cc(C(=O)Nc2cccc(NC(=O)c3cc(OC)cc(OC)c3)n2)c1
InChIInChI=1S/C23H23N3O6/c1-29-16-8-14(9-17(12-16)30-2)22(27)25-20-6-5-7-21(24-20)26-23(28)15-10-18(31-3)13-19(11-15)32-4/h5-13H,1-4H3,(H2,24,25,26,27,28)
InChIKeyHLPGQLZRWOUVNI-UHFFFAOYSA-N
MW437.45 g/mol
LogP3.62
Rot. Bonds8

About N-[6-[(3,5-dimethoxybenzoyl)amino]-2-pyridinyl]-3,5-dimethoxybenzamide

N-[6-[(3,5-dimethoxybenzoyl)amino]-2-pyridinyl]-3,5-dimethoxybenzamide (PubChem CID 1035470) has the molecular formula C23H23N3O6 and a molecular weight of 437.45 g/mol. Its IUPAC name is N-[6-[(3,5-dimethoxybenzoyl)amino]-2-pyridinyl]-3,5-dimethoxybenzamide.

Molecular Properties

Compound NameN-[6-[(3,5-dimethoxybenzoyl)amino]-2-pyridinyl]-3,5-dimethoxybenzamide
PubChem CID1035470
Molecular FormulaC23H23N3O6
Molecular Weight437.45 g/mol
Exact Mass437.16
IUPAC NameN-[6-[(3,5-dimethoxybenzoyl)amino]-2-pyridinyl]-3,5-dimethoxybenzamide
SMILESCOc1cc(OC)cc(C(=O)Nc2cccc(NC(=O)c3cc(OC)cc(OC)c3)n2)c1
InChIInChI=1S/C23H23N3O6/c1-29-16-8-14(9-17(12-16)30-2)22(27)25-20-6-5-7-21(24-20)26-23(28)15-10-18(31-3)13-19(11-15)32-4/h5-13H,1-4H3,(H2,24,25,26,27,28)
InChIKeyHLPGQLZRWOUVNI-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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Frequently Asked Questions

What is the IUPAC name of N-[6-[(3,5-dimethoxybenzoyl)amino]-2-pyridinyl]-3,5-dimethoxybenzamide?
The IUPAC name of N-[6-[(3,5-dimethoxybenzoyl)amino]-2-pyridinyl]-3,5-dimethoxybenzamide (CID 1035470) is N-[6-[(3,5-dimethoxybenzoyl)amino]-2-pyridinyl]-3,5-dimethoxybenzamide.
What is the SMILES notation for N-[6-[(3,5-dimethoxybenzoyl)amino]-2-pyridinyl]-3,5-dimethoxybenzamide?
The canonical SMILES for N-[6-[(3,5-dimethoxybenzoyl)amino]-2-pyridinyl]-3,5-dimethoxybenzamide is COc1cc(OC)cc(C(=O)Nc2cccc(NC(=O)c3cc(OC)cc(OC)c3)n2)c1.
What is the InChIKey of N-[6-[(3,5-dimethoxybenzoyl)amino]-2-pyridinyl]-3,5-dimethoxybenzamide?
The InChIKey is HLPGQLZRWOUVNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O6/c1-29-16-8-14(9-17(12-16)30-2)22(27)25-20-6-5-7-21(24-20)26-23(28)15-10-18(31-3)13-19(11-15)32-4/h5-13H,1-4H3,(H2,24,25,26,27,28).
What are the key properties of N-[6-[(3,5-dimethoxybenzoyl)amino]-2-pyridinyl]-3,5-dimethoxybenzamide?
N-[6-[(3,5-dimethoxybenzoyl)amino]-2-pyridinyl]-3,5-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-[(3,5-dimethoxybenzoyl)amino]-2-pyridinyl]-3,5-dimethoxybenzamide is sourced from PubChem (CID 1035470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).