9-(2-aminoethyl)-5-fluoro-2-methylfluoren-9-ol

C16H16FNO — CID 59757171

IUPAC9-(2-aminoethyl)-5-fluoro-2-methylfluoren-9-ol
SMILESCc1ccc2c(c1)C(O)(CCN)c1cccc(F)c1-2
InChIInChI=1S/C16H16FNO/c1-10-5-6-11-13(9-10)16(19,7-8-18)12-3-2-4-14(17)15(11)12/h2-6,9,19H,7-8,18H2,1H3
InChIKeyBSNHNVZLHHVPEJ-UHFFFAOYSA-N
MW257.31 g/mol
LogP2.70
Rot. Bonds2

About 9-(2-aminoethyl)-5-fluoro-2-methylfluoren-9-ol

9-(2-aminoethyl)-5-fluoro-2-methylfluoren-9-ol (PubChem CID 59757171) has the molecular formula C16H16FNO and a molecular weight of 257.31 g/mol. Its IUPAC name is 9-(2-aminoethyl)-5-fluoro-2-methylfluoren-9-ol.

Molecular Properties

Compound Name9-(2-aminoethyl)-5-fluoro-2-methylfluoren-9-ol
PubChem CID59757171
Molecular FormulaC16H16FNO
Molecular Weight257.31 g/mol
Exact Mass257.12
IUPAC Name9-(2-aminoethyl)-5-fluoro-2-methylfluoren-9-ol
SMILESCc1ccc2c(c1)C(O)(CCN)c1cccc(F)c1-2
InChIInChI=1S/C16H16FNO/c1-10-5-6-11-13(9-10)16(19,7-8-18)12-3-2-4-14(17)15(11)12/h2-6,9,19H,7-8,18H2,1H3
InChIKeyBSNHNVZLHHVPEJ-UHFFFAOYSA-N
XLogP2.70
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.31
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-(2-aminoethyl)-5-fluoro-2-methylfluoren-9-ol?
The IUPAC name of 9-(2-aminoethyl)-5-fluoro-2-methylfluoren-9-ol (CID 59757171) is 9-(2-aminoethyl)-5-fluoro-2-methylfluoren-9-ol.
What is the SMILES notation for 9-(2-aminoethyl)-5-fluoro-2-methylfluoren-9-ol?
The canonical SMILES for 9-(2-aminoethyl)-5-fluoro-2-methylfluoren-9-ol is Cc1ccc2c(c1)C(O)(CCN)c1cccc(F)c1-2.
What is the InChIKey of 9-(2-aminoethyl)-5-fluoro-2-methylfluoren-9-ol?
The InChIKey is BSNHNVZLHHVPEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO/c1-10-5-6-11-13(9-10)16(19,7-8-18)12-3-2-4-14(17)15(11)12/h2-6,9,19H,7-8,18H2,1H3.
What are the key properties of 9-(2-aminoethyl)-5-fluoro-2-methylfluoren-9-ol?
9-(2-aminoethyl)-5-fluoro-2-methylfluoren-9-ol has a molecular weight of 257.31 g/mol, XLogP of 2.70, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2-aminoethyl)-5-fluoro-2-methylfluoren-9-ol is sourced from PubChem (CID 59757171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).