7,7-dimethyl-N-(2-methylphenyl)-2,5-dioxo-6,8-dihydro-1H-quinoline-3-carboxamide

C19H20N2O3 — CID 15988425

IUPAC7,7-dimethyl-N-(2-methylphenyl)-2,5-dioxo-6,8-dihydro-1H-quinoline-3-carboxamide
SMILESCc1ccccc1NC(=O)c1cc2c([nH]c1=O)CC(C)(C)CC2=O
InChIInChI=1S/C19H20N2O3/c1-11-6-4-5-7-14(11)20-17(23)13-8-12-15(21-18(13)24)9-19(2,3)10-16(12)22/h4-8H,9-10H2,1-3H3,(H,20,23)(H,21,24)
InChIKeyGWPZCRDVHHAWDZ-UHFFFAOYSA-N
MW324.38 g/mol
LogP3.09
Rot. Bonds2

About 7,7-dimethyl-N-(2-methylphenyl)-2,5-dioxo-6,8-dihydro-1H-quinoline-3-carboxamide

7,7-dimethyl-N-(2-methylphenyl)-2,5-dioxo-6,8-dihydro-1H-quinoline-3-carboxamide (PubChem CID 15988425) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is 7,7-dimethyl-N-(2-methylphenyl)-2,5-dioxo-6,8-dihydro-1H-quinoline-3-carboxamide.

Molecular Properties

Compound Name7,7-dimethyl-N-(2-methylphenyl)-2,5-dioxo-6,8-dihydro-1H-quinoline-3-carboxamide
PubChem CID15988425
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC Name7,7-dimethyl-N-(2-methylphenyl)-2,5-dioxo-6,8-dihydro-1H-quinoline-3-carboxamide
SMILESCc1ccccc1NC(=O)c1cc2c([nH]c1=O)CC(C)(C)CC2=O
InChIInChI=1S/C19H20N2O3/c1-11-6-4-5-7-14(11)20-17(23)13-8-12-15(21-18(13)24)9-19(2,3)10-16(12)22/h4-8H,9-10H2,1-3H3,(H,20,23)(H,21,24)
InChIKeyGWPZCRDVHHAWDZ-UHFFFAOYSA-N
XLogP3.09
TPSA79.03 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7,7-dimethyl-N-(2-methylphenyl)-2,5-dioxo-6,8-dihydro-1H-quinoline-3-carboxamide?
The IUPAC name of 7,7-dimethyl-N-(2-methylphenyl)-2,5-dioxo-6,8-dihydro-1H-quinoline-3-carboxamide (CID 15988425) is 7,7-dimethyl-N-(2-methylphenyl)-2,5-dioxo-6,8-dihydro-1H-quinoline-3-carboxamide.
What is the SMILES notation for 7,7-dimethyl-N-(2-methylphenyl)-2,5-dioxo-6,8-dihydro-1H-quinoline-3-carboxamide?
The canonical SMILES for 7,7-dimethyl-N-(2-methylphenyl)-2,5-dioxo-6,8-dihydro-1H-quinoline-3-carboxamide is Cc1ccccc1NC(=O)c1cc2c([nH]c1=O)CC(C)(C)CC2=O.
What is the InChIKey of 7,7-dimethyl-N-(2-methylphenyl)-2,5-dioxo-6,8-dihydro-1H-quinoline-3-carboxamide?
The InChIKey is GWPZCRDVHHAWDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-11-6-4-5-7-14(11)20-17(23)13-8-12-15(21-18(13)24)9-19(2,3)10-16(12)22/h4-8H,9-10H2,1-3H3,(H,20,23)(H,21,24).
What are the key properties of 7,7-dimethyl-N-(2-methylphenyl)-2,5-dioxo-6,8-dihydro-1H-quinoline-3-carboxamide?
7,7-dimethyl-N-(2-methylphenyl)-2,5-dioxo-6,8-dihydro-1H-quinoline-3-carboxamide has a molecular weight of 324.38 g/mol, XLogP of 3.09, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7-dimethyl-N-(2-methylphenyl)-2,5-dioxo-6,8-dihydro-1H-quinoline-3-carboxamide is sourced from PubChem (CID 15988425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).