9H-fluoren-2-ylthiourea

C14H12N2S — CID 1477129

IUPAC9H-fluoren-2-ylthiourea
SMILESNC(=S)Nc1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C14H12N2S/c15-14(17)16-11-5-6-13-10(8-11)7-9-3-1-2-4-12(9)13/h1-6,8H,7H2,(H3,15,16,17)
InChIKeyCVQDYBYEKHWWCH-UHFFFAOYSA-N
MW240.33 g/mol
LogP2.91
Rot. Bonds1

About 9H-fluoren-2-ylthiourea

9H-fluoren-2-ylthiourea (PubChem CID 1477129) has the molecular formula C14H12N2S and a molecular weight of 240.33 g/mol. Its IUPAC name is 9H-fluoren-2-ylthiourea.

Molecular Properties

Compound Name9H-fluoren-2-ylthiourea
PubChem CID1477129
Molecular FormulaC14H12N2S
Molecular Weight240.33 g/mol
Exact Mass240.07
IUPAC Name9H-fluoren-2-ylthiourea
SMILESNC(=S)Nc1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C14H12N2S/c15-14(17)16-11-5-6-13-10(8-11)7-9-3-1-2-4-12(9)13/h1-6,8H,7H2,(H3,15,16,17)
InChIKeyCVQDYBYEKHWWCH-UHFFFAOYSA-N
XLogP2.91
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Analyze 9H-fluoren-2-ylthiourea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Alpha-Naphthylthiourea
CID 736366
2,7-Diaminofluorene
CID 10679
Mls002608127
CID 4201092
1-(2-Naphthyl)-2-thiourea
CID 2829258
N,N'-Bis(4-methylphenyl)thiourea
CID 688021
(3,4-Dimethylphenyl)thiourea
CID 854809
(4-Ethylphenyl)thiourea
CID 2758896
Carbanilide, 4-methylthio-
CID 853904
N-[4'-(trifluoromethyl)-4-biphenylyl]thiourea
CID 11652296
1-(2,3-dihydro-1H-inden-5-yl)-3-phenylurea
CID 4530884
1-(2,3-dihydro-1H-inden-5-yl)-3-(4-fluorophenyl)urea
CID 24818652
1-(2,3-dihydro-1H-inden-5-yl)-3-(4-methylphenyl)urea
CID 24819566

Frequently Asked Questions

What is the IUPAC name of 9H-fluoren-2-ylthiourea?
The IUPAC name of 9H-fluoren-2-ylthiourea (CID 1477129) is 9H-fluoren-2-ylthiourea.
What is the SMILES notation for 9H-fluoren-2-ylthiourea?
The canonical SMILES for 9H-fluoren-2-ylthiourea is NC(=S)Nc1ccc2c(c1)Cc1ccccc1-2.
What is the InChIKey of 9H-fluoren-2-ylthiourea?
The InChIKey is CVQDYBYEKHWWCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2S/c15-14(17)16-11-5-6-13-10(8-11)7-9-3-1-2-4-12(9)13/h1-6,8H,7H2,(H3,15,16,17).
What are the key properties of 9H-fluoren-2-ylthiourea?
9H-fluoren-2-ylthiourea has a molecular weight of 240.33 g/mol, XLogP of 2.91, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-fluoren-2-ylthiourea is sourced from PubChem (CID 1477129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).