9,9-dimethyl-10-naphthalen-2-yl-2-(4-phenylnaphthalen-1-yl)acridine

C41H31N — CID 118472936

IUPAC9,9-dimethyl-10-naphthalen-2-yl-2-(4-phenylnaphthalen-1-yl)acridine
SMILESCC1(C)c2ccccc2N(c2ccc3ccccc3c2)c2ccc(-c3ccc(-c4ccccc4)c4ccccc34)cc21
InChIInChI=1S/C41H31N/c1-41(2)37-18-10-11-19-39(37)42(32-22-20-28-12-6-7-15-30(28)26-32)40-25-21-31(27-38(40)41)34-24-23-33(29-13-4-3-5-14-29)35-16-8-9-17-36(34)35/h3-27H,1-2H3
InChIKeyMFGXQBKFFOVOJS-UHFFFAOYSA-N
MW537.71 g/mol
LogP11.44
Rot. Bonds3

About 9,9-dimethyl-10-naphthalen-2-yl-2-(4-phenylnaphthalen-1-yl)acridine

9,9-dimethyl-10-naphthalen-2-yl-2-(4-phenylnaphthalen-1-yl)acridine (PubChem CID 118472936) has the molecular formula C41H31N and a molecular weight of 537.71 g/mol. Its IUPAC name is 9,9-dimethyl-10-naphthalen-2-yl-2-(4-phenylnaphthalen-1-yl)acridine.

Molecular Properties

Compound Name9,9-dimethyl-10-naphthalen-2-yl-2-(4-phenylnaphthalen-1-yl)acridine
PubChem CID118472936
Molecular FormulaC41H31N
Molecular Weight537.71 g/mol
Exact Mass537.25
IUPAC Name9,9-dimethyl-10-naphthalen-2-yl-2-(4-phenylnaphthalen-1-yl)acridine
SMILESCC1(C)c2ccccc2N(c2ccc3ccccc3c2)c2ccc(-c3ccc(-c4ccccc4)c4ccccc34)cc21
InChIInChI=1S/C41H31N/c1-41(2)37-18-10-11-19-39(37)42(32-22-20-28-12-6-7-15-30(28)26-32)40-25-21-31(27-38(40)41)34-24-23-33(29-13-4-3-5-14-29)35-16-8-9-17-36(34)35/h3-27H,1-2H3
InChIKeyMFGXQBKFFOVOJS-UHFFFAOYSA-N
XLogP11.44
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500537.71
LogP ≤ 511.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(9,9-dimethylacridin-10-yl)-9,9-dimethyl-10-phenyl-7-(4-phenylquinazolin-2-yl)acridine
CID 134579023
10-[14-(9,9-dimethylfluoren-2-yl)-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-10-yl]-14-naphthalen-2-yl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene
CID 122659751
10-[6-(9,9-dimethylacridin-10-yl)-9,10-dinaphthalen-2-ylanthracen-2-yl]-9,9-dimethylacridine
CID 59219732
9,9-dimethyl-10-phenanthren-3-ylacridine
CID 155173536
N-naphthalen-2-yl-N-phenyl-5-(8,8,14,14-tetramethyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-1-amine
CID 70893250
14-(9,9-dimethyl-7-phenylfluoren-2-yl)-10,10,21,21-tetramethyl-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene
CID 130439455
10-[14-(9,9-dimethylfluoren-2-yl)-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-10-yl]-14-naphthalen-2-yl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene;10-[14-(9,9-dimethylfluoren-2-yl)-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-10-yl]-14-phenyl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene;10-[14-(9,9-dimethylfluoren-2-yl)-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-10-yl]-14-(3-phenylphenyl)-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene
CID 158973199
2-[6-(9,9-dimethyl-10-phenylacridin-2-yl)-2-pyridinyl]-9,9-dimethyl-10-phenylacridine
CID 59399596
10,10-dimethyl-9H-anthracene;9,9-dimethyl-10-naphthalen-2-ylacridine
CID 164974789
10-(4,6-diphenyl-2-pyridinyl)-9,9-dimethyl-2-naphthalen-2-ylacridine
CID 118472939
2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9,9-dimethyl-10-phenylacridine
CID 71007170
N,N-diphenyl-4-(8,8,14,14-tetramethyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15,17,19-nonaen-5-yl)naphthalen-1-amine
CID 70893267

Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-10-naphthalen-2-yl-2-(4-phenylnaphthalen-1-yl)acridine?
The IUPAC name of 9,9-dimethyl-10-naphthalen-2-yl-2-(4-phenylnaphthalen-1-yl)acridine (CID 118472936) is 9,9-dimethyl-10-naphthalen-2-yl-2-(4-phenylnaphthalen-1-yl)acridine.
What is the SMILES notation for 9,9-dimethyl-10-naphthalen-2-yl-2-(4-phenylnaphthalen-1-yl)acridine?
The canonical SMILES for 9,9-dimethyl-10-naphthalen-2-yl-2-(4-phenylnaphthalen-1-yl)acridine is CC1(C)c2ccccc2N(c2ccc3ccccc3c2)c2ccc(-c3ccc(-c4ccccc4)c4ccccc34)cc21.
What is the InChIKey of 9,9-dimethyl-10-naphthalen-2-yl-2-(4-phenylnaphthalen-1-yl)acridine?
The InChIKey is MFGXQBKFFOVOJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H31N/c1-41(2)37-18-10-11-19-39(37)42(32-22-20-28-12-6-7-15-30(28)26-32)40-25-21-31(27-38(40)41)34-24-23-33(29-13-4-3-5-14-29)35-16-8-9-17-36(34)35/h3-27H,1-2H3.
What are the key properties of 9,9-dimethyl-10-naphthalen-2-yl-2-(4-phenylnaphthalen-1-yl)acridine?
9,9-dimethyl-10-naphthalen-2-yl-2-(4-phenylnaphthalen-1-yl)acridine has a molecular weight of 537.71 g/mol, XLogP of 11.44, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-10-naphthalen-2-yl-2-(4-phenylnaphthalen-1-yl)acridine is sourced from PubChem (CID 118472936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).