2-(dimethylamino)naphtho[2,1-g]quinoline-7,12-dione

C19H14N2O2 — CID 23239458

IUPAC2-(dimethylamino)naphtho[2,1-g]quinoline-7,12-dione
SMILESCN(C)c1ccc2ccc3c(c2c1)C(=O)c1ncccc1C3=O
InChIInChI=1S/C19H14N2O2/c1-21(2)12-7-5-11-6-8-13-16(15(11)10-12)19(23)17-14(18(13)22)4-3-9-20-17/h3-10H,1-2H3
InChIKeyADRVYIONVJPEJK-UHFFFAOYSA-N
MW302.33 g/mol
LogP3.08
Rot. Bonds1

About 2-(dimethylamino)naphtho[2,1-g]quinoline-7,12-dione

2-(dimethylamino)naphtho[2,1-g]quinoline-7,12-dione (PubChem CID 23239458) has the molecular formula C19H14N2O2 and a molecular weight of 302.33 g/mol. Its IUPAC name is 2-(dimethylamino)naphtho[2,1-g]quinoline-7,12-dione.

Molecular Properties

Compound Name2-(dimethylamino)naphtho[2,1-g]quinoline-7,12-dione
PubChem CID23239458
Molecular FormulaC19H14N2O2
Molecular Weight302.33 g/mol
Exact Mass302.11
IUPAC Name2-(dimethylamino)naphtho[2,1-g]quinoline-7,12-dione
SMILESCN(C)c1ccc2ccc3c(c2c1)C(=O)c1ncccc1C3=O
InChIInChI=1S/C19H14N2O2/c1-21(2)12-7-5-11-6-8-13-16(15(11)10-12)19(23)17-14(18(13)22)4-3-9-20-17/h3-10H,1-2H3
InChIKeyADRVYIONVJPEJK-UHFFFAOYSA-N
XLogP3.08
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quinone_A(370)', 'substructure': 'N/A'}

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Related Compounds

9-(dimethylamino)-11-methylpyrido[2,3-b]acridine-5,12-dione
CID 11823262
naphtho[1,2-h]quinoline-11,12-dione
CID 126542594
phenanthro[9,10-g]quinoline-9,14-dione
CID 71437214
9,11-dimethylpyrido[2,3-b]acridine-5,12-dione
CID 10946126
3-[(dimethylamino)methyl]pyrido[3,2-g]quinoline-5,10-dione
CID 10880058
12-methylquinolino[7,6-a]carbazole-5,13-dione
CID 46193683
4,7-phenanthroline-5,6-dione
CID 6764
ethyl 9-(4-methylphenyl)-5,10-dioxopyrido[4,3-g]quinoline-7-carboxylate
CID 11280197
6,10,16-triazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2(7),3,5,9,11,13(17),14-octaen-8-one
CID 15480973
1,2-dibromophenaleno[2,3-b]pyridin-7-one
CID 151541746
7-(dimethylamino)-3-pyrimidin-2-ylchromen-2-one
CID 58667740
5,5-bis[2-(chloromethyl)-4-(dimethylamino)phenyl]furo[3,4-b]pyridin-7-one
CID 139642796

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)naphtho[2,1-g]quinoline-7,12-dione?
The IUPAC name of 2-(dimethylamino)naphtho[2,1-g]quinoline-7,12-dione (CID 23239458) is 2-(dimethylamino)naphtho[2,1-g]quinoline-7,12-dione.
What is the SMILES notation for 2-(dimethylamino)naphtho[2,1-g]quinoline-7,12-dione?
The canonical SMILES for 2-(dimethylamino)naphtho[2,1-g]quinoline-7,12-dione is CN(C)c1ccc2ccc3c(c2c1)C(=O)c1ncccc1C3=O.
What is the InChIKey of 2-(dimethylamino)naphtho[2,1-g]quinoline-7,12-dione?
The InChIKey is ADRVYIONVJPEJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2O2/c1-21(2)12-7-5-11-6-8-13-16(15(11)10-12)19(23)17-14(18(13)22)4-3-9-20-17/h3-10H,1-2H3.
What are the key properties of 2-(dimethylamino)naphtho[2,1-g]quinoline-7,12-dione?
2-(dimethylamino)naphtho[2,1-g]quinoline-7,12-dione has a molecular weight of 302.33 g/mol, XLogP of 3.08, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)naphtho[2,1-g]quinoline-7,12-dione is sourced from PubChem (CID 23239458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).