[4-[(7,9,9-trimethylfluoren-2-yl)amino]phenyl]methanol

C23H23NO — CID 170093919

IUPAC[4-[(7,9,9-trimethylfluoren-2-yl)amino]phenyl]methanol
SMILESCc1ccc2c(c1)C(C)(C)c1cc(Nc3ccc(CO)cc3)ccc1-2
InChIInChI=1S/C23H23NO/c1-15-4-10-19-20-11-9-18(13-22(20)23(2,3)21(19)12-15)24-17-7-5-16(14-25)6-8-17/h4-13,24-25H,14H2,1-3H3
InChIKeyVNGPUGUFTAIQCV-UHFFFAOYSA-N
MW329.44 g/mol
LogP5.54
Rot. Bonds3

About [4-[(7,9,9-trimethylfluoren-2-yl)amino]phenyl]methanol

[4-[(7,9,9-trimethylfluoren-2-yl)amino]phenyl]methanol (PubChem CID 170093919) has the molecular formula C23H23NO and a molecular weight of 329.44 g/mol. Its IUPAC name is [4-[(7,9,9-trimethylfluoren-2-yl)amino]phenyl]methanol.

Molecular Properties

Compound Name[4-[(7,9,9-trimethylfluoren-2-yl)amino]phenyl]methanol
PubChem CID170093919
Molecular FormulaC23H23NO
Molecular Weight329.44 g/mol
Exact Mass329.18
IUPAC Name[4-[(7,9,9-trimethylfluoren-2-yl)amino]phenyl]methanol
SMILESCc1ccc2c(c1)C(C)(C)c1cc(Nc3ccc(CO)cc3)ccc1-2
InChIInChI=1S/C23H23NO/c1-15-4-10-19-20-11-9-18(13-22(20)23(2,3)21(19)12-15)24-17-7-5-16(14-25)6-8-17/h4-13,24-25H,14H2,1-3H3
InChIKeyVNGPUGUFTAIQCV-UHFFFAOYSA-N
XLogP5.54
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.44
LogP ≤ 55.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-[(7,9,9-trimethylfluoren-2-yl)amino]phenyl]methanol?
The IUPAC name of [4-[(7,9,9-trimethylfluoren-2-yl)amino]phenyl]methanol (CID 170093919) is [4-[(7,9,9-trimethylfluoren-2-yl)amino]phenyl]methanol.
What is the SMILES notation for [4-[(7,9,9-trimethylfluoren-2-yl)amino]phenyl]methanol?
The canonical SMILES for [4-[(7,9,9-trimethylfluoren-2-yl)amino]phenyl]methanol is Cc1ccc2c(c1)C(C)(C)c1cc(Nc3ccc(CO)cc3)ccc1-2.
What is the InChIKey of [4-[(7,9,9-trimethylfluoren-2-yl)amino]phenyl]methanol?
The InChIKey is VNGPUGUFTAIQCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO/c1-15-4-10-19-20-11-9-18(13-22(20)23(2,3)21(19)12-15)24-17-7-5-16(14-25)6-8-17/h4-13,24-25H,14H2,1-3H3.
What are the key properties of [4-[(7,9,9-trimethylfluoren-2-yl)amino]phenyl]methanol?
[4-[(7,9,9-trimethylfluoren-2-yl)amino]phenyl]methanol has a molecular weight of 329.44 g/mol, XLogP of 5.54, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(7,9,9-trimethylfluoren-2-yl)amino]phenyl]methanol is sourced from PubChem (CID 170093919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).