4-(9,9-dimethylfluoren-2-yl)quinazolin-2-amine

C23H19N3 — CID 146421035

IUPAC4-(9,9-dimethylfluoren-2-yl)quinazolin-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(-c3nc(N)nc4ccccc34)cc21
InChIInChI=1S/C23H19N3/c1-23(2)18-9-5-3-7-15(18)16-12-11-14(13-19(16)23)21-17-8-4-6-10-20(17)25-22(24)26-21/h3-13H,1-2H3,(H2,24,25,26)
InChIKeyLLRGVIFMGIIHDP-UHFFFAOYSA-N
MW337.43 g/mol
LogP5.19
Rot. Bonds1

About 4-(9,9-dimethylfluoren-2-yl)quinazolin-2-amine

4-(9,9-dimethylfluoren-2-yl)quinazolin-2-amine (PubChem CID 146421035) has the molecular formula C23H19N3 and a molecular weight of 337.43 g/mol. Its IUPAC name is 4-(9,9-dimethylfluoren-2-yl)quinazolin-2-amine.

Molecular Properties

Compound Name4-(9,9-dimethylfluoren-2-yl)quinazolin-2-amine
PubChem CID146421035
Molecular FormulaC23H19N3
Molecular Weight337.43 g/mol
Exact Mass337.16
IUPAC Name4-(9,9-dimethylfluoren-2-yl)quinazolin-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(-c3nc(N)nc4ccccc34)cc21
InChIInChI=1S/C23H19N3/c1-23(2)18-9-5-3-7-15(18)16-12-11-14(13-19(16)23)21-17-8-4-6-10-20(17)25-22(24)26-21/h3-13H,1-2H3,(H2,24,25,26)
InChIKeyLLRGVIFMGIIHDP-UHFFFAOYSA-N
XLogP5.19
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.43
LogP ≤ 55.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(9,9-dimethylfluoren-2-yl)quinazolin-2-amine 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

2-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-4-(3-phenylphenyl)quinazoline;2-[4-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-4-phenylquinazoline
CID 167612820
2-[4-(9,9-dimethylfluoren-2-yl)naphthalen-1-yl]-9,9-dimethylfluorene
CID 59133432
4-(11H-benzo[b]fluoren-2-yl)-2-(9,9-dimethylfluoren-2-yl)quinazoline
CID 154589148
6-(9,9-dimethylfluoren-2-yl)-2-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-phenylpyridine
CID 58881124
4-(7-bromo-9,9-dimethylfluoren-2-yl)-2-phenylquinazoline
CID 129208486
4,6-bis(9,9-dimethylfluoren-2-yl)-2-(4-phenanthridin-6-ylphenyl)benzo[h]quinoline
CID 70836389
10-(9,9-dimethylfluoren-2-yl)-9-azatetracyclo[10.2.1.02,11.03,8]pentadeca-2(11),3,5,7,9-pentaene
CID 90076832
2-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-1-yl)-4-(9,9-dimethylfluoren-2-yl)quinazoline
CID 140907283
2-[4-(9,9-dimethylfluoren-2-yl)naphthalen-1-yl]-4,6-bis(2-phenylphenyl)-1,3,5-triazine
CID 118427220
2-(23,23-dimethyl-20-hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17(22),18,20-dodecaenyl)-4-phenylquinazoline
CID 118472845
2-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9-(4-phenylquinazolin-2-yl)carbazole
CID 129312343
2-(4-dibenzothiophen-1-ylphenyl)-3-(9,9-dimethylfluoren-2-yl)quinoxaline
CID 164985271

Frequently Asked Questions

What is the IUPAC name of 4-(9,9-dimethylfluoren-2-yl)quinazolin-2-amine?
The IUPAC name of 4-(9,9-dimethylfluoren-2-yl)quinazolin-2-amine (CID 146421035) is 4-(9,9-dimethylfluoren-2-yl)quinazolin-2-amine.
What is the SMILES notation for 4-(9,9-dimethylfluoren-2-yl)quinazolin-2-amine?
The canonical SMILES for 4-(9,9-dimethylfluoren-2-yl)quinazolin-2-amine is CC1(C)c2ccccc2-c2ccc(-c3nc(N)nc4ccccc34)cc21.
What is the InChIKey of 4-(9,9-dimethylfluoren-2-yl)quinazolin-2-amine?
The InChIKey is LLRGVIFMGIIHDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3/c1-23(2)18-9-5-3-7-15(18)16-12-11-14(13-19(16)23)21-17-8-4-6-10-20(17)25-22(24)26-21/h3-13H,1-2H3,(H2,24,25,26).
What are the key properties of 4-(9,9-dimethylfluoren-2-yl)quinazolin-2-amine?
4-(9,9-dimethylfluoren-2-yl)quinazolin-2-amine has a molecular weight of 337.43 g/mol, XLogP of 5.19, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(9,9-dimethylfluoren-2-yl)quinazolin-2-amine is sourced from PubChem (CID 146421035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).