N-(9H-fluoren-1-yl)-1,3-oxazol-2-amine

C16H12N2O — CID 150855095

IUPACN-(9H-fluoren-1-yl)-1,3-oxazol-2-amine
SMILESc1ccc2c(c1)Cc1c(Nc3ncco3)cccc1-2
InChIInChI=1S/C16H12N2O/c1-2-5-12-11(4-1)10-14-13(12)6-3-7-15(14)18-16-17-8-9-19-16/h1-9H,10H2,(H,17,18)
InChIKeyKQVRCTDECLYZDW-UHFFFAOYSA-N
MW248.29 g/mol
LogP3.99
Rot. Bonds2

About N-(9H-fluoren-1-yl)-1,3-oxazol-2-amine

N-(9H-fluoren-1-yl)-1,3-oxazol-2-amine (PubChem CID 150855095) has the molecular formula C16H12N2O and a molecular weight of 248.29 g/mol. Its IUPAC name is N-(9H-fluoren-1-yl)-1,3-oxazol-2-amine.

Molecular Properties

Compound NameN-(9H-fluoren-1-yl)-1,3-oxazol-2-amine
PubChem CID150855095
Molecular FormulaC16H12N2O
Molecular Weight248.29 g/mol
Exact Mass248.09
IUPAC NameN-(9H-fluoren-1-yl)-1,3-oxazol-2-amine
SMILESc1ccc2c(c1)Cc1c(Nc3ncco3)cccc1-2
InChIInChI=1S/C16H12N2O/c1-2-5-12-11(4-1)10-14-13(12)6-3-7-15(14)18-16-17-8-9-19-16/h1-9H,10H2,(H,17,18)
InChIKeyKQVRCTDECLYZDW-UHFFFAOYSA-N
XLogP3.99
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.29
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(9H-fluoren-1-yl)-1,3-oxazol-2-amine?
The IUPAC name of N-(9H-fluoren-1-yl)-1,3-oxazol-2-amine (CID 150855095) is N-(9H-fluoren-1-yl)-1,3-oxazol-2-amine.
What is the SMILES notation for N-(9H-fluoren-1-yl)-1,3-oxazol-2-amine?
The canonical SMILES for N-(9H-fluoren-1-yl)-1,3-oxazol-2-amine is c1ccc2c(c1)Cc1c(Nc3ncco3)cccc1-2.
What is the InChIKey of N-(9H-fluoren-1-yl)-1,3-oxazol-2-amine?
The InChIKey is KQVRCTDECLYZDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O/c1-2-5-12-11(4-1)10-14-13(12)6-3-7-15(14)18-16-17-8-9-19-16/h1-9H,10H2,(H,17,18).
What are the key properties of N-(9H-fluoren-1-yl)-1,3-oxazol-2-amine?
N-(9H-fluoren-1-yl)-1,3-oxazol-2-amine has a molecular weight of 248.29 g/mol, XLogP of 3.99, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9H-fluoren-1-yl)-1,3-oxazol-2-amine is sourced from PubChem (CID 150855095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).