CID 166569822

C33H26NO — CID 166569822

IUPAC—
SMILESCC1(C)c2ccccc2Oc2ccc(-c3ccc([C](c4ccccc4)c4ccncc4)cc3)cc21
InChIInChI=1S/C33H26NO/c1-33(2)28-10-6-7-11-30(28)35-31-17-16-27(22-29(31)33)23-12-14-25(15-13-23)32(24-8-4-3-5-9-24)26-18-20-34-21-19-26/h3-22H,1-2H3
InChIKeyOSOGAURGGDZVHK-UHFFFAOYSA-N
MW452.58 g/mol
LogP8.20
Rot. Bonds4

About CID 166569822

CID 166569822 (PubChem CID 166569822) has the molecular formula C33H26NO and a molecular weight of 452.58 g/mol.

Molecular Properties

Compound NameCID 166569822
PubChem CID166569822
Molecular FormulaC33H26NO
Molecular Weight452.58 g/mol
Exact Mass452.20
IUPAC Name—
SMILESCC1(C)c2ccccc2Oc2ccc(-c3ccc([C](c4ccccc4)c4ccncc4)cc3)cc21
InChIInChI=1S/C33H26NO/c1-33(2)28-10-6-7-11-30(28)35-31-17-16-27(22-29(31)33)23-12-14-25(15-13-23)32(24-8-4-3-5-9-24)26-18-20-34-21-19-26/h3-22H,1-2H3
InChIKeyOSOGAURGGDZVHK-UHFFFAOYSA-N
XLogP8.20
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500452.58
LogP ≤ 58.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(9,9-dimethylxanthen-2-yl)-9,9-dimethylxanthene
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2-(9,9-dimethyl-7-phenylxanthen-2-yl)-9,9-dimethyl-7-phenylxanthene
CID 70935966
N-[4-(9,9-dimethylxanthen-2-yl)phenyl]-N-[4-[4-(N-[4-(9,9-dimethylxanthen-2-yl)phenyl]-4-phenylanilino)phenyl]phenyl]-4-phenylaniline
CID 90365627
N-[4-(9,9-dimethylxanthen-2-yl)phenyl]-4-phenyl-N-[4-(3-phenylphenyl)phenyl]aniline
CID 118134290
2-[4-(9,9-dimethylxanthen-2-yl)phenyl]-4-phenylquinazoline
CID 166908596
2-(9,9-dimethylxanthen-2-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine
CID 163787598
N,N-bis[4-(9,9-dimethylxanthen-2-yl)phenyl]-4-naphthalen-2-ylaniline
CID 90365679
N-[4-(9,9-dimethylxanthen-2-yl)phenyl]-4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline
CID 90365672
2-(9,9-diphenylfluoren-2-yl)-9,9-dimethylxanthene
CID 170018311
5,5-dimethyl-3-phenylchromeno[2,3-c]pyridine
CID 158580057
4-(17-phenylspiro[tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8(13),9,11,16,18-nonaene-14,9'-xanthene]-11-yl)pyridine
CID 134571333
4-[4-[4-(9,9-dimethylxanthen-4-yl)-N-[4-(9,9-dimethylxanthen-4-yl)phenyl]anilino]phenyl]-N,N-bis[4-(9,9-dimethylxanthen-2-yl)phenyl]aniline
CID 90365709

Frequently Asked Questions

What is the IUPAC name of CID 166569822?
The IUPAC name of CID 166569822 (CID 166569822) is not available.
What is the SMILES notation for CID 166569822?
The canonical SMILES for CID 166569822 is CC1(C)c2ccccc2Oc2ccc(-c3ccc([C](c4ccccc4)c4ccncc4)cc3)cc21.
What is the InChIKey of CID 166569822?
The InChIKey is OSOGAURGGDZVHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H26NO/c1-33(2)28-10-6-7-11-30(28)35-31-17-16-27(22-29(31)33)23-12-14-25(15-13-23)32(24-8-4-3-5-9-24)26-18-20-34-21-19-26/h3-22H,1-2H3.
What are the key properties of CID 166569822?
CID 166569822 has a molecular weight of 452.58 g/mol, XLogP of 8.20, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 166569822 is sourced from PubChem (CID 166569822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).