3-amino-N-(9H-fluoren-2-yl)propane-1-sulfonamide

C16H18N2O2S — CID 60910333

IUPAC3-amino-N-(9H-fluoren-2-yl)propane-1-sulfonamide
SMILESNCCCS(=O)(=O)Nc1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C16H18N2O2S/c17-8-3-9-21(19,20)18-14-6-7-16-13(11-14)10-12-4-1-2-5-15(12)16/h1-2,4-7,11,18H,3,8-10,17H2
InChIKeyYSBYOZMUUGJVEW-UHFFFAOYSA-N
MW302.40 g/mol
LogP2.35
Rot. Bonds5

About 3-amino-N-(9H-fluoren-2-yl)propane-1-sulfonamide

3-amino-N-(9H-fluoren-2-yl)propane-1-sulfonamide (PubChem CID 60910333) has the molecular formula C16H18N2O2S and a molecular weight of 302.40 g/mol. Its IUPAC name is 3-amino-N-(9H-fluoren-2-yl)propane-1-sulfonamide.

Molecular Properties

Compound Name3-amino-N-(9H-fluoren-2-yl)propane-1-sulfonamide
PubChem CID60910333
Molecular FormulaC16H18N2O2S
Molecular Weight302.40 g/mol
Exact Mass302.11
IUPAC Name3-amino-N-(9H-fluoren-2-yl)propane-1-sulfonamide
SMILESNCCCS(=O)(=O)Nc1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C16H18N2O2S/c17-8-3-9-21(19,20)18-14-6-7-16-13(11-14)10-12-4-1-2-5-15(12)16/h1-2,4-7,11,18H,3,8-10,17H2
InChIKeyYSBYOZMUUGJVEW-UHFFFAOYSA-N
XLogP2.35
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.40
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(9H-fluoren-2-yl)propane-1-sulfonamide?
The IUPAC name of 3-amino-N-(9H-fluoren-2-yl)propane-1-sulfonamide (CID 60910333) is 3-amino-N-(9H-fluoren-2-yl)propane-1-sulfonamide.
What is the SMILES notation for 3-amino-N-(9H-fluoren-2-yl)propane-1-sulfonamide?
The canonical SMILES for 3-amino-N-(9H-fluoren-2-yl)propane-1-sulfonamide is NCCCS(=O)(=O)Nc1ccc2c(c1)Cc1ccccc1-2.
What is the InChIKey of 3-amino-N-(9H-fluoren-2-yl)propane-1-sulfonamide?
The InChIKey is YSBYOZMUUGJVEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2S/c17-8-3-9-21(19,20)18-14-6-7-16-13(11-14)10-12-4-1-2-5-15(12)16/h1-2,4-7,11,18H,3,8-10,17H2.
What are the key properties of 3-amino-N-(9H-fluoren-2-yl)propane-1-sulfonamide?
3-amino-N-(9H-fluoren-2-yl)propane-1-sulfonamide has a molecular weight of 302.40 g/mol, XLogP of 2.35, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(9H-fluoren-2-yl)propane-1-sulfonamide is sourced from PubChem (CID 60910333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).