N-(1,3-thiazol-5-ylmethyl)-9H-fluoren-2-amine

C17H14N2S — CID 62759027

IUPACN-(1,3-thiazol-5-ylmethyl)-9H-fluoren-2-amine
SMILESc1ccc2c(c1)Cc1cc(NCc3cncs3)ccc1-2
InChIInChI=1S/C17H14N2S/c1-2-4-16-12(3-1)7-13-8-14(5-6-17(13)16)19-10-15-9-18-11-20-15/h1-6,8-9,11,19H,7,10H2
InChIKeyCGOMKAULTIDLQM-UHFFFAOYSA-N
MW278.38 g/mol
LogP4.33
Rot. Bonds3

About N-(1,3-thiazol-5-ylmethyl)-9H-fluoren-2-amine

N-(1,3-thiazol-5-ylmethyl)-9H-fluoren-2-amine (PubChem CID 62759027) has the molecular formula C17H14N2S and a molecular weight of 278.38 g/mol. Its IUPAC name is N-(1,3-thiazol-5-ylmethyl)-9H-fluoren-2-amine.

Molecular Properties

Compound NameN-(1,3-thiazol-5-ylmethyl)-9H-fluoren-2-amine
PubChem CID62759027
Molecular FormulaC17H14N2S
Molecular Weight278.38 g/mol
Exact Mass278.09
IUPAC NameN-(1,3-thiazol-5-ylmethyl)-9H-fluoren-2-amine
SMILESc1ccc2c(c1)Cc1cc(NCc3cncs3)ccc1-2
InChIInChI=1S/C17H14N2S/c1-2-4-16-12(3-1)7-13-8-14(5-6-17(13)16)19-10-15-9-18-11-20-15/h1-6,8-9,11,19H,7,10H2
InChIKeyCGOMKAULTIDLQM-UHFFFAOYSA-N
XLogP4.33
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.38
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1,3-thiazol-5-ylmethyl)-9H-fluoren-2-amine?
The IUPAC name of N-(1,3-thiazol-5-ylmethyl)-9H-fluoren-2-amine (CID 62759027) is N-(1,3-thiazol-5-ylmethyl)-9H-fluoren-2-amine.
What is the SMILES notation for N-(1,3-thiazol-5-ylmethyl)-9H-fluoren-2-amine?
The canonical SMILES for N-(1,3-thiazol-5-ylmethyl)-9H-fluoren-2-amine is c1ccc2c(c1)Cc1cc(NCc3cncs3)ccc1-2.
What is the InChIKey of N-(1,3-thiazol-5-ylmethyl)-9H-fluoren-2-amine?
The InChIKey is CGOMKAULTIDLQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2S/c1-2-4-16-12(3-1)7-13-8-14(5-6-17(13)16)19-10-15-9-18-11-20-15/h1-6,8-9,11,19H,7,10H2.
What are the key properties of N-(1,3-thiazol-5-ylmethyl)-9H-fluoren-2-amine?
N-(1,3-thiazol-5-ylmethyl)-9H-fluoren-2-amine has a molecular weight of 278.38 g/mol, XLogP of 4.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-thiazol-5-ylmethyl)-9H-fluoren-2-amine is sourced from PubChem (CID 62759027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).