N-(9H-fluoren-9-yl)thiolan-3-amine

C17H17NS — CID 103603285

IUPACN-(9H-fluoren-9-yl)thiolan-3-amine
SMILESc1ccc2c(c1)-c1ccccc1C2NC1CCSC1
InChIInChI=1S/C17H17NS/c1-3-7-15-13(5-1)14-6-2-4-8-16(14)17(15)18-12-9-10-19-11-12/h1-8,12,17-18H,9-11H2
InChIKeyXMPNJZSWUSYOFQ-UHFFFAOYSA-N
MW267.40 g/mol
LogP3.85
Rot. Bonds2

About N-(9H-fluoren-9-yl)thiolan-3-amine

N-(9H-fluoren-9-yl)thiolan-3-amine (PubChem CID 103603285) has the molecular formula C17H17NS and a molecular weight of 267.40 g/mol. Its IUPAC name is N-(9H-fluoren-9-yl)thiolan-3-amine.

Molecular Properties

Compound NameN-(9H-fluoren-9-yl)thiolan-3-amine
PubChem CID103603285
Molecular FormulaC17H17NS
Molecular Weight267.40 g/mol
Exact Mass267.11
IUPAC NameN-(9H-fluoren-9-yl)thiolan-3-amine
SMILESc1ccc2c(c1)-c1ccccc1C2NC1CCSC1
InChIInChI=1S/C17H17NS/c1-3-7-15-13(5-1)14-6-2-4-8-16(14)17(15)18-12-9-10-19-11-12/h1-8,12,17-18H,9-11H2
InChIKeyXMPNJZSWUSYOFQ-UHFFFAOYSA-N
XLogP3.85
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.40
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(9H-fluoren-9-yl)thiolan-3-amine?
The IUPAC name of N-(9H-fluoren-9-yl)thiolan-3-amine (CID 103603285) is N-(9H-fluoren-9-yl)thiolan-3-amine.
What is the SMILES notation for N-(9H-fluoren-9-yl)thiolan-3-amine?
The canonical SMILES for N-(9H-fluoren-9-yl)thiolan-3-amine is c1ccc2c(c1)-c1ccccc1C2NC1CCSC1.
What is the InChIKey of N-(9H-fluoren-9-yl)thiolan-3-amine?
The InChIKey is XMPNJZSWUSYOFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NS/c1-3-7-15-13(5-1)14-6-2-4-8-16(14)17(15)18-12-9-10-19-11-12/h1-8,12,17-18H,9-11H2.
What are the key properties of N-(9H-fluoren-9-yl)thiolan-3-amine?
N-(9H-fluoren-9-yl)thiolan-3-amine has a molecular weight of 267.40 g/mol, XLogP of 3.85, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9H-fluoren-9-yl)thiolan-3-amine is sourced from PubChem (CID 103603285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).