1-N,3-N-bis(3,5-dimethyl-4-pyridinyl)-5-methoxybenzene-1,3-dicarboxamide

C23H24N4O3 — CID 11211855

IUPAC1-N,3-N-bis(3,5-dimethyl-4-pyridinyl)-5-methoxybenzene-1,3-dicarboxamide
SMILESCOc1cc(C(=O)Nc2c(C)cncc2C)cc(C(=O)Nc2c(C)cncc2C)c1
InChIInChI=1S/C23H24N4O3/c1-13-9-24-10-14(2)20(13)26-22(28)17-6-18(8-19(7-17)30-5)23(29)27-21-15(3)11-25-12-16(21)4/h6-12H,1-5H3,(H,24,26,28)(H,25,27,29)
InChIKeyJMTPUEQQKAQZJM-UHFFFAOYSA-N
MW404.47 g/mol
LogP4.22
Rot. Bonds5

About 1-N,3-N-bis(3,5-dimethyl-4-pyridinyl)-5-methoxybenzene-1,3-dicarboxamide

1-N,3-N-bis(3,5-dimethyl-4-pyridinyl)-5-methoxybenzene-1,3-dicarboxamide (PubChem CID 11211855) has the molecular formula C23H24N4O3 and a molecular weight of 404.47 g/mol. Its IUPAC name is 1-N,3-N-bis(3,5-dimethyl-4-pyridinyl)-5-methoxybenzene-1,3-dicarboxamide.

Molecular Properties

Compound Name1-N,3-N-bis(3,5-dimethyl-4-pyridinyl)-5-methoxybenzene-1,3-dicarboxamide
PubChem CID11211855
Molecular FormulaC23H24N4O3
Molecular Weight404.47 g/mol
Exact Mass404.18
IUPAC Name1-N,3-N-bis(3,5-dimethyl-4-pyridinyl)-5-methoxybenzene-1,3-dicarboxamide
SMILESCOc1cc(C(=O)Nc2c(C)cncc2C)cc(C(=O)Nc2c(C)cncc2C)c1
InChIInChI=1S/C23H24N4O3/c1-13-9-24-10-14(2)20(13)26-22(28)17-6-18(8-19(7-17)30-5)23(29)27-21-15(3)11-25-12-16(21)4/h6-12H,1-5H3,(H,24,26,28)(H,25,27,29)
InChIKeyJMTPUEQQKAQZJM-UHFFFAOYSA-N
XLogP4.22
TPSA93.21 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.47
LogP ≤ 54.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-N-(4-methoxyphenyl)-5-N-(2,4,6-trimethylphenyl)pyridine-3,5-dicarboxamide
CID 109108631
3-amino-5-methoxy-N-(2,4,6-trimethylphenyl)benzamide
CID 78984369
5-N-(3,4-dimethylphenyl)-3-N-(4-methoxyphenyl)pyridine-3,5-dicarboxamide
CID 109108317
N-(4-methoxy-2,6-dimethylphenyl)acetamide
CID 5268765
N-(4-iodo-2,5-dimethylphenyl)-3,5-dimethoxybenzamide
CID 2206635
3-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-methoxybenzamide
CID 81090898
N-[5-(2,6-dimethylanilino)-2-pyridinyl]-3,5-dimethoxybenzamide
CID 113032259
5-(2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)pyridine-3-carboxamide
CID 109243138
3-amino-N-(2,6-dichloro-3-methylphenyl)-5-methoxybenzamide
CID 81093926
1-N-(4-methoxyphenyl)-3-N-(2,4,6-trimethylphenyl)benzene-1,3-dicarboxamide
CID 109057390
3,5-dimethoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide
CID 22170540
methyl 3-[(3,5-dimethoxybenzoyl)amino]-4-methylbenzoate
CID 967197

Frequently Asked Questions

What is the IUPAC name of 1-N,3-N-bis(3,5-dimethyl-4-pyridinyl)-5-methoxybenzene-1,3-dicarboxamide?
The IUPAC name of 1-N,3-N-bis(3,5-dimethyl-4-pyridinyl)-5-methoxybenzene-1,3-dicarboxamide (CID 11211855) is 1-N,3-N-bis(3,5-dimethyl-4-pyridinyl)-5-methoxybenzene-1,3-dicarboxamide.
What is the SMILES notation for 1-N,3-N-bis(3,5-dimethyl-4-pyridinyl)-5-methoxybenzene-1,3-dicarboxamide?
The canonical SMILES for 1-N,3-N-bis(3,5-dimethyl-4-pyridinyl)-5-methoxybenzene-1,3-dicarboxamide is COc1cc(C(=O)Nc2c(C)cncc2C)cc(C(=O)Nc2c(C)cncc2C)c1.
What is the InChIKey of 1-N,3-N-bis(3,5-dimethyl-4-pyridinyl)-5-methoxybenzene-1,3-dicarboxamide?
The InChIKey is JMTPUEQQKAQZJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O3/c1-13-9-24-10-14(2)20(13)26-22(28)17-6-18(8-19(7-17)30-5)23(29)27-21-15(3)11-25-12-16(21)4/h6-12H,1-5H3,(H,24,26,28)(H,25,27,29).
What are the key properties of 1-N,3-N-bis(3,5-dimethyl-4-pyridinyl)-5-methoxybenzene-1,3-dicarboxamide?
1-N,3-N-bis(3,5-dimethyl-4-pyridinyl)-5-methoxybenzene-1,3-dicarboxamide has a molecular weight of 404.47 g/mol, XLogP of 4.22, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,3-N-bis(3,5-dimethyl-4-pyridinyl)-5-methoxybenzene-1,3-dicarboxamide is sourced from PubChem (CID 11211855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).