10-phenylspiro[acridine-9,5'-pyrido[4,3-g]isoquinoline]-10'-one

C30H19N3O — CID 159430495

IUPAC10-phenylspiro[acridine-9,5'-pyrido[4,3-g]isoquinoline]-10'-one
SMILESO=C1c2cnccc2C2(c3ccncc31)c1ccccc1N(c1ccccc1)c1ccccc12
InChIInChI=1S/C30H19N3O/c34-29-21-18-31-16-14-23(21)30(24-15-17-32-19-22(24)29)25-10-4-6-12-27(25)33(20-8-2-1-3-9-20)28-13-7-5-11-26(28)30/h1-19H
InChIKeyONQYASUMXYUDOS-UHFFFAOYSA-N
MW437.50 g/mol
LogP6.19
Rot. Bonds1

About 10-phenylspiro[acridine-9,5'-pyrido[4,3-g]isoquinoline]-10'-one

10-phenylspiro[acridine-9,5'-pyrido[4,3-g]isoquinoline]-10'-one (PubChem CID 159430495) has the molecular formula C30H19N3O and a molecular weight of 437.50 g/mol. Its IUPAC name is 10-phenylspiro[acridine-9,5'-pyrido[4,3-g]isoquinoline]-10'-one.

Molecular Properties

Compound Name10-phenylspiro[acridine-9,5'-pyrido[4,3-g]isoquinoline]-10'-one
PubChem CID159430495
Molecular FormulaC30H19N3O
Molecular Weight437.50 g/mol
Exact Mass437.15
IUPAC Name10-phenylspiro[acridine-9,5'-pyrido[4,3-g]isoquinoline]-10'-one
SMILESO=C1c2cnccc2C2(c3ccncc31)c1ccccc1N(c1ccccc1)c1ccccc12
InChIInChI=1S/C30H19N3O/c34-29-21-18-31-16-14-23(21)30(24-15-17-32-19-22(24)29)25-10-4-6-12-27(25)33(20-8-2-1-3-9-20)28-13-7-5-11-26(28)30/h1-19H
InChIKeyONQYASUMXYUDOS-UHFFFAOYSA-N
XLogP6.19
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500437.50
LogP ≤ 56.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

10'-phenylspiro[anthracene-10,5'-benzo[b][1,8]naphthyridine]-9-one
CID 161296094
10-phenyl-3-pyridin-4-ylspiro[acridine-9,9'-fluorene]
CID 146495033
5'-phenylspiro[benzo[g]quinoline-10,10'-pyrido[3,2-b][1,5]naphthyridine]-5-one
CID 159980149
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
2-[5-[4-(benzenesulfonyl)phenyl]indeno[1,2-c]pyridin-5-yl]-9,9-dimethyl-10-phenylacridine
CID 155273596
10-phenyl-2',7'-bis(10-phenylspiro[acridine-9,9'-fluorene]-2'-yl)spiro[acridine-9,9'-fluorene]
CID 102164734
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-5'-pyridin-4-ylspiro[acridine-9,8'-indeno[2,1-c]phenothiazine] 13',13'-dioxide
CID 163588404
9,9-bis(2-methylphenyl)-10-phenylacridine
CID 59470095
10-phenyl-9,9-dipyridin-2-ylacridine
CID 58029185
CID 137451109
CID 137451109
2',10-diphenyl-4'-pyridin-4-ylspiro[acridine-9,5'-indeno[1,2-d]pyrimidine]
CID 118372584

Frequently Asked Questions

What is the IUPAC name of 10-phenylspiro[acridine-9,5'-pyrido[4,3-g]isoquinoline]-10'-one?
The IUPAC name of 10-phenylspiro[acridine-9,5'-pyrido[4,3-g]isoquinoline]-10'-one (CID 159430495) is 10-phenylspiro[acridine-9,5'-pyrido[4,3-g]isoquinoline]-10'-one.
What is the SMILES notation for 10-phenylspiro[acridine-9,5'-pyrido[4,3-g]isoquinoline]-10'-one?
The canonical SMILES for 10-phenylspiro[acridine-9,5'-pyrido[4,3-g]isoquinoline]-10'-one is O=C1c2cnccc2C2(c3ccncc31)c1ccccc1N(c1ccccc1)c1ccccc12.
What is the InChIKey of 10-phenylspiro[acridine-9,5'-pyrido[4,3-g]isoquinoline]-10'-one?
The InChIKey is ONQYASUMXYUDOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H19N3O/c34-29-21-18-31-16-14-23(21)30(24-15-17-32-19-22(24)29)25-10-4-6-12-27(25)33(20-8-2-1-3-9-20)28-13-7-5-11-26(28)30/h1-19H.
What are the key properties of 10-phenylspiro[acridine-9,5'-pyrido[4,3-g]isoquinoline]-10'-one?
10-phenylspiro[acridine-9,5'-pyrido[4,3-g]isoquinoline]-10'-one has a molecular weight of 437.50 g/mol, XLogP of 6.19, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 10-phenylspiro[acridine-9,5'-pyrido[4,3-g]isoquinoline]-10'-one is sourced from PubChem (CID 159430495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).