5'-phenylspiro[benzo[g]quinoline-10,10'-pyrido[3,2-b][1,5]naphthyridine]-5-one

C29H18N4O — CID 159980149

IUPAC5'-phenylspiro[benzo[g]quinoline-10,10'-pyrido[3,2-b][1,5]naphthyridine]-5-one
SMILESO=C1c2ccccc2C2(c3ncccc31)c1ncccc1N(c1ccccc1)c1cccnc12
InChIInChI=1S/C29H18N4O/c34-25-20-11-4-5-13-22(20)29(26-21(25)12-6-16-30-26)27-23(14-7-17-31-27)33(19-9-2-1-3-10-19)24-15-8-18-32-28(24)29/h1-18H
InChIKeyWORAMVYPJWJQRI-UHFFFAOYSA-N
MW438.49 g/mol
LogP5.58
Rot. Bonds1

About 5'-phenylspiro[benzo[g]quinoline-10,10'-pyrido[3,2-b][1,5]naphthyridine]-5-one

5'-phenylspiro[benzo[g]quinoline-10,10'-pyrido[3,2-b][1,5]naphthyridine]-5-one (PubChem CID 159980149) has the molecular formula C29H18N4O and a molecular weight of 438.49 g/mol. Its IUPAC name is 5'-phenylspiro[benzo[g]quinoline-10,10'-pyrido[3,2-b][1,5]naphthyridine]-5-one.

Molecular Properties

Compound Name5'-phenylspiro[benzo[g]quinoline-10,10'-pyrido[3,2-b][1,5]naphthyridine]-5-one
PubChem CID159980149
Molecular FormulaC29H18N4O
Molecular Weight438.49 g/mol
Exact Mass438.15
IUPAC Name5'-phenylspiro[benzo[g]quinoline-10,10'-pyrido[3,2-b][1,5]naphthyridine]-5-one
SMILESO=C1c2ccccc2C2(c3ncccc31)c1ncccc1N(c1ccccc1)c1cccnc12
InChIInChI=1S/C29H18N4O/c34-25-20-11-4-5-13-22(20)29(26-21(25)12-6-16-30-26)27-23(14-7-17-31-27)33(19-9-2-1-3-10-19)24-15-8-18-32-28(24)29/h1-18H
InChIKeyWORAMVYPJWJQRI-UHFFFAOYSA-N
XLogP5.58
TPSA58.98 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500438.49
LogP ≤ 55.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

10'-phenylspiro[anthracene-10,5'-benzo[b][1,8]naphthyridine]-9-one
CID 161296094
10-phenylspiro[acridine-9,5'-pyrido[4,3-g]isoquinoline]-10'-one
CID 159430495
spiro[fluorene-9,9'-indeno[2,1-b]pyridine]
CID 129265256
CID 138579740
CID 138579740
21',21'-dimethyl-10-phenylspiro[acridine-9,10'-pentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene]-14'-one
CID 164838773
21,21-dimethyl-14-phenylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-10,10'-anthracene]-9'-one
CID 71249599
10-phenyl-9,9-dipyridin-2-ylacridine
CID 58029185
10-(9,9-dimethyl-10-phenylacridin-2-yl)-10-phenylanthracen-9-one
CID 140898964
21-phenylspiro[14-thia-21-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-10,10'-anthracene]-9'-one
CID 71249547
2',7'-bis(9,9-dimethylacridin-10-yl)-10'-phenylspiro[6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-acridine];2',7'-di(carbazol-9-yl)-10'-phenylspiro[6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-acridine];2'-(9,9-dimethylacridin-10-yl)-10'-phenylspiro[6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-acridine];10-(7'-phenoxazin-10-yl-10'-phenylspiro[6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-acridine]-2'-yl)phenoxazine
CID 160667766
10-phenyl-3,6-bis(pyrido[2,3-b]indol-9-yl)spiro[acridine-9,9'-fluorene]
CID 122367920
10-phenyl-10'-[3-(trifluoromethyl)-2-pyridinyl]-9,9'-spirobi[acridine]
CID 139575024

Frequently Asked Questions

What is the IUPAC name of 5'-phenylspiro[benzo[g]quinoline-10,10'-pyrido[3,2-b][1,5]naphthyridine]-5-one?
The IUPAC name of 5'-phenylspiro[benzo[g]quinoline-10,10'-pyrido[3,2-b][1,5]naphthyridine]-5-one (CID 159980149) is 5'-phenylspiro[benzo[g]quinoline-10,10'-pyrido[3,2-b][1,5]naphthyridine]-5-one.
What is the SMILES notation for 5'-phenylspiro[benzo[g]quinoline-10,10'-pyrido[3,2-b][1,5]naphthyridine]-5-one?
The canonical SMILES for 5'-phenylspiro[benzo[g]quinoline-10,10'-pyrido[3,2-b][1,5]naphthyridine]-5-one is O=C1c2ccccc2C2(c3ncccc31)c1ncccc1N(c1ccccc1)c1cccnc12.
What is the InChIKey of 5'-phenylspiro[benzo[g]quinoline-10,10'-pyrido[3,2-b][1,5]naphthyridine]-5-one?
The InChIKey is WORAMVYPJWJQRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H18N4O/c34-25-20-11-4-5-13-22(20)29(26-21(25)12-6-16-30-26)27-23(14-7-17-31-27)33(19-9-2-1-3-10-19)24-15-8-18-32-28(24)29/h1-18H.
What are the key properties of 5'-phenylspiro[benzo[g]quinoline-10,10'-pyrido[3,2-b][1,5]naphthyridine]-5-one?
5'-phenylspiro[benzo[g]quinoline-10,10'-pyrido[3,2-b][1,5]naphthyridine]-5-one has a molecular weight of 438.49 g/mol, XLogP of 5.58, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5'-phenylspiro[benzo[g]quinoline-10,10'-pyrido[3,2-b][1,5]naphthyridine]-5-one is sourced from PubChem (CID 159980149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).