6-[(2,5-dioxopyrrolidin-1-yl)amino]-N-(4-methylphenyl)pyridine-3-carboxamide

C17H16N4O3 — CID 46507746

IUPAC6-[(2,5-dioxopyrrolidin-1-yl)amino]-N-(4-methylphenyl)pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(NN3C(=O)CCC3=O)nc2)cc1
InChIInChI=1S/C17H16N4O3/c1-11-2-5-13(6-3-11)19-17(24)12-4-7-14(18-10-12)20-21-15(22)8-9-16(21)23/h2-7,10H,8-9H2,1H3,(H,18,20)(H,19,24)
InChIKeyCUXLIOIYZUTDDA-UHFFFAOYSA-N
MW324.34 g/mol
LogP2.12
Rot. Bonds4

About 6-[(2,5-dioxopyrrolidin-1-yl)amino]-N-(4-methylphenyl)pyridine-3-carboxamide

6-[(2,5-dioxopyrrolidin-1-yl)amino]-N-(4-methylphenyl)pyridine-3-carboxamide (PubChem CID 46507746) has the molecular formula C17H16N4O3 and a molecular weight of 324.34 g/mol. Its IUPAC name is 6-[(2,5-dioxopyrrolidin-1-yl)amino]-N-(4-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[(2,5-dioxopyrrolidin-1-yl)amino]-N-(4-methylphenyl)pyridine-3-carboxamide
PubChem CID46507746
Molecular FormulaC17H16N4O3
Molecular Weight324.34 g/mol
Exact Mass324.12
IUPAC Name6-[(2,5-dioxopyrrolidin-1-yl)amino]-N-(4-methylphenyl)pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(NN3C(=O)CCC3=O)nc2)cc1
InChIInChI=1S/C17H16N4O3/c1-11-2-5-13(6-3-11)19-17(24)12-4-7-14(18-10-12)20-21-15(22)8-9-16(21)23/h2-7,10H,8-9H2,1H3,(H,18,20)(H,19,24)
InChIKeyCUXLIOIYZUTDDA-UHFFFAOYSA-N
XLogP2.12
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.34
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

N-(4-methylphenyl)-6-[(1-methylpiperidin-4-yl)amino]pyridine-3-carboxamide
CID 133383281
6-[(1-tert-butyl-5-oxopyrrolidin-3-yl)amino]-N-(4-methylphenyl)pyridine-3-carboxamide
CID 133342318
N-(4-bromophenyl)-6-[(4-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109155992
N-(4-methylphenyl)-6-[[1-(1-methylpyrazol-4-yl)-2-oxopyrrolidin-3-yl]amino]pyridine-3-carboxamide
CID 133306403
N-(4-methylphenyl)-6-[4-(trifluoromethyl)anilino]pyridine-3-carboxamide
CID 109162294
4-methyl-N-[6-(4-methylanilino)-3-pyridinyl]benzamide
CID 113016330
N-[6-(ethylamino)-3-pyridinyl]-4-methylbenzamide
CID 115268582
N-[4-(diethylamino)phenyl]-6-(4-methylanilino)pyridine-3-carboxamide
CID 109162272
6-[[3-methyl-1-(methylamino)-1-oxobutan-2-yl]amino]-N-(4-methylphenyl)pyridine-3-carboxamide
CID 133388134
6-[2-(2,2-dimethylpropanoylamino)ethylamino]-N-(4-methylphenyl)pyridine-3-carboxamide
CID 133326827
6-[(2-ethylsulfanyl-1-hydroxycyclobutyl)methylamino]-N-(4-methylphenyl)pyridine-3-carboxamide
CID 133357915
6-[[2-(cyclopropylmethylamino)-2-oxoethyl]amino]-N-(4-methylphenyl)pyridine-3-carboxamide
CID 133441834

Frequently Asked Questions

What is the IUPAC name of 6-[(2,5-dioxopyrrolidin-1-yl)amino]-N-(4-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-[(2,5-dioxopyrrolidin-1-yl)amino]-N-(4-methylphenyl)pyridine-3-carboxamide (CID 46507746) is 6-[(2,5-dioxopyrrolidin-1-yl)amino]-N-(4-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-[(2,5-dioxopyrrolidin-1-yl)amino]-N-(4-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-[(2,5-dioxopyrrolidin-1-yl)amino]-N-(4-methylphenyl)pyridine-3-carboxamide is Cc1ccc(NC(=O)c2ccc(NN3C(=O)CCC3=O)nc2)cc1.
What is the InChIKey of 6-[(2,5-dioxopyrrolidin-1-yl)amino]-N-(4-methylphenyl)pyridine-3-carboxamide?
The InChIKey is CUXLIOIYZUTDDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O3/c1-11-2-5-13(6-3-11)19-17(24)12-4-7-14(18-10-12)20-21-15(22)8-9-16(21)23/h2-7,10H,8-9H2,1H3,(H,18,20)(H,19,24).
What are the key properties of 6-[(2,5-dioxopyrrolidin-1-yl)amino]-N-(4-methylphenyl)pyridine-3-carboxamide?
6-[(2,5-dioxopyrrolidin-1-yl)amino]-N-(4-methylphenyl)pyridine-3-carboxamide has a molecular weight of 324.34 g/mol, XLogP of 2.12, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2,5-dioxopyrrolidin-1-yl)amino]-N-(4-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 46507746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).