N-[1-(9H-fluoren-2-yl)ethyl]thiadiazol-5-amine

C17H15N3S — CID 107649387

IUPACN-[1-(9H-fluoren-2-yl)ethyl]thiadiazol-5-amine
SMILESCC(Nc1cnns1)c1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C17H15N3S/c1-11(19-17-10-18-20-21-17)12-6-7-16-14(8-12)9-13-4-2-3-5-15(13)16/h2-8,10-11,19H,9H2,1H3
InChIKeyGULYUFZWRLZWPX-UHFFFAOYSA-N
MW293.40 g/mol
LogP4.28
Rot. Bonds3

About N-[1-(9H-fluoren-2-yl)ethyl]thiadiazol-5-amine

N-[1-(9H-fluoren-2-yl)ethyl]thiadiazol-5-amine (PubChem CID 107649387) has the molecular formula C17H15N3S and a molecular weight of 293.40 g/mol. Its IUPAC name is N-[1-(9H-fluoren-2-yl)ethyl]thiadiazol-5-amine.

Molecular Properties

Compound NameN-[1-(9H-fluoren-2-yl)ethyl]thiadiazol-5-amine
PubChem CID107649387
Molecular FormulaC17H15N3S
Molecular Weight293.40 g/mol
Exact Mass293.10
IUPAC NameN-[1-(9H-fluoren-2-yl)ethyl]thiadiazol-5-amine
SMILESCC(Nc1cnns1)c1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C17H15N3S/c1-11(19-17-10-18-20-21-17)12-6-7-16-14(8-12)9-13-4-2-3-5-15(13)16/h2-8,10-11,19H,9H2,1H3
InChIKeyGULYUFZWRLZWPX-UHFFFAOYSA-N
XLogP4.28
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.40
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(9H-fluoren-2-yl)ethyl]thiadiazol-5-amine?
The IUPAC name of N-[1-(9H-fluoren-2-yl)ethyl]thiadiazol-5-amine (CID 107649387) is N-[1-(9H-fluoren-2-yl)ethyl]thiadiazol-5-amine.
What is the SMILES notation for N-[1-(9H-fluoren-2-yl)ethyl]thiadiazol-5-amine?
The canonical SMILES for N-[1-(9H-fluoren-2-yl)ethyl]thiadiazol-5-amine is CC(Nc1cnns1)c1ccc2c(c1)Cc1ccccc1-2.
What is the InChIKey of N-[1-(9H-fluoren-2-yl)ethyl]thiadiazol-5-amine?
The InChIKey is GULYUFZWRLZWPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3S/c1-11(19-17-10-18-20-21-17)12-6-7-16-14(8-12)9-13-4-2-3-5-15(13)16/h2-8,10-11,19H,9H2,1H3.
What are the key properties of N-[1-(9H-fluoren-2-yl)ethyl]thiadiazol-5-amine?
N-[1-(9H-fluoren-2-yl)ethyl]thiadiazol-5-amine has a molecular weight of 293.40 g/mol, XLogP of 4.28, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(9H-fluoren-2-yl)ethyl]thiadiazol-5-amine is sourced from PubChem (CID 107649387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).