8,12-dimethyl-7,11-dihydroindolizino[1,2-b]quinolin-7-id-9-one;yttrium

C17H13N2OY- — CID 58756407

IUPAC8,12-dimethyl-7,11-dihydroindolizino[1,2-b]quinolin-7-id-9-one;yttrium
SMILESCc1[c-]cc2n(c1=O)Cc1c-2nc2ccccc2c1C.[Y]
InChIInChI=1S/C17H13N2O.Y/c1-10-7-8-15-16-13(9-19(15)17(10)20)11(2)12-5-3-4-6-14(12)18-16;/h3-6,8H,9H2,1-2H3;/q-1;
InChIKeyGYMRONWXJIUJOP-UHFFFAOYSA-N
MW350.21 g/mol
LogP2.84
Rot. Bonds

About 8,12-dimethyl-7,11-dihydroindolizino[1,2-b]quinolin-7-id-9-one;yttrium

8,12-dimethyl-7,11-dihydroindolizino[1,2-b]quinolin-7-id-9-one;yttrium (PubChem CID 58756407) has the molecular formula C17H13N2OY- and a molecular weight of 350.21 g/mol. Its IUPAC name is 8,12-dimethyl-7,11-dihydroindolizino[1,2-b]quinolin-7-id-9-one;yttrium.

Molecular Properties

Compound Name8,12-dimethyl-7,11-dihydroindolizino[1,2-b]quinolin-7-id-9-one;yttrium
PubChem CID58756407
Molecular FormulaC17H13N2OY-
Molecular Weight350.21 g/mol
Exact Mass350.01
IUPAC Name8,12-dimethyl-7,11-dihydroindolizino[1,2-b]quinolin-7-id-9-one;yttrium
SMILESCc1[c-]cc2n(c1=O)Cc1c-2nc2ccccc2c1C.[Y]
InChIInChI=1S/C17H13N2O.Y/c1-10-7-8-15-16-13(9-19(15)17(10)20)11(2)12-5-3-4-6-14(12)18-16;/h3-6,8H,9H2,1-2H3;/q-1;
InChIKeyGYMRONWXJIUJOP-UHFFFAOYSA-N
XLogP2.84
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.21
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 8,12-dimethyl-7,11-dihydroindolizino[1,2-b]quinolin-7-id-9-one;yttrium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethane;8-(hydroxymethyl)-7-(1-hydroxy-2-oxopropyl)-12-methyl-11H-indolizino[1,2-b]quinolin-9-one
CID 177022472
10-[(dimethylamino)methyl]-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15,17,19-nonaen-14-one
CID 24949391
(19S)-10-benzyl-19-ethyl-19-hydroxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione
CID 13192383
(19S)-19-ethyl-19-hydroxy-10-triethylsilyl-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione
CID 15481511
(19S)-19-ethyl-19-hydroxy-10-propanoyl-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione
CID 15406058
(19S)-19-ethyl-19-hydroxy-10-(5-hydroxypentyl)-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione
CID 53378522
(19S)-19-ethyl-19-hydroxy-10-(3-methoxypropyl)-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione
CID 171408325
(19S)-19-ethyl-19-hydroxy-7-methoxy-10-methyl-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2(11),3,5,7,9,15(20)-heptaene-14,18-dione
CID 57181553
ethane;(12-ethyl-7-methyl-9-oxo-11H-indolizino[1,2-b]quinolin-8-yl)methyl propanoate
CID 163276518
(12-ethyl-7-methoxy-9-oxo-11H-indolizino[1,2-b]quinolin-8-yl)methyl acetate
CID 171621749
19-ethyl-19-hydroxy-8,10-dimethyl-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione
CID 10429595
(19S)-19-ethyl-10-[(E)-hydrazinylidenemethyl]-19-hydroxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione
CID 15916820

Frequently Asked Questions

What is the IUPAC name of 8,12-dimethyl-7,11-dihydroindolizino[1,2-b]quinolin-7-id-9-one;yttrium?
The IUPAC name of 8,12-dimethyl-7,11-dihydroindolizino[1,2-b]quinolin-7-id-9-one;yttrium (CID 58756407) is 8,12-dimethyl-7,11-dihydroindolizino[1,2-b]quinolin-7-id-9-one;yttrium.
What is the SMILES notation for 8,12-dimethyl-7,11-dihydroindolizino[1,2-b]quinolin-7-id-9-one;yttrium?
The canonical SMILES for 8,12-dimethyl-7,11-dihydroindolizino[1,2-b]quinolin-7-id-9-one;yttrium is Cc1[c-]cc2n(c1=O)Cc1c-2nc2ccccc2c1C.[Y].
What is the InChIKey of 8,12-dimethyl-7,11-dihydroindolizino[1,2-b]quinolin-7-id-9-one;yttrium?
The InChIKey is GYMRONWXJIUJOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N2O.Y/c1-10-7-8-15-16-13(9-19(15)17(10)20)11(2)12-5-3-4-6-14(12)18-16;/h3-6,8H,9H2,1-2H3;/q-1;.
What are the key properties of 8,12-dimethyl-7,11-dihydroindolizino[1,2-b]quinolin-7-id-9-one;yttrium?
8,12-dimethyl-7,11-dihydroindolizino[1,2-b]quinolin-7-id-9-one;yttrium has a molecular weight of 350.21 g/mol, XLogP of 2.84, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8,12-dimethyl-7,11-dihydroindolizino[1,2-b]quinolin-7-id-9-one;yttrium is sourced from PubChem (CID 58756407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).