(2,5,6-trichloro-9H-fluoren-9-yl)methanamine

C14H10Cl3N — CID 82579380

IUPAC(2,5,6-trichloro-9H-fluoren-9-yl)methanamine
SMILESNCC1c2cc(Cl)ccc2-c2c1ccc(Cl)c2Cl
InChIInChI=1S/C14H10Cl3N/c15-7-1-2-8-10(5-7)11(6-18)9-3-4-12(16)14(17)13(8)9/h1-5,11H,6,18H2
InChIKeyWTCVUVVEICCPDE-UHFFFAOYSA-N
MW298.60 g/mol
LogP4.72
Rot. Bonds1

About (2,5,6-trichloro-9H-fluoren-9-yl)methanamine

(2,5,6-trichloro-9H-fluoren-9-yl)methanamine (PubChem CID 82579380) has the molecular formula C14H10Cl3N and a molecular weight of 298.60 g/mol. Its IUPAC name is (2,5,6-trichloro-9H-fluoren-9-yl)methanamine.

Molecular Properties

Compound Name(2,5,6-trichloro-9H-fluoren-9-yl)methanamine
PubChem CID82579380
Molecular FormulaC14H10Cl3N
Molecular Weight298.60 g/mol
Exact Mass296.99
IUPAC Name(2,5,6-trichloro-9H-fluoren-9-yl)methanamine
SMILESNCC1c2cc(Cl)ccc2-c2c1ccc(Cl)c2Cl
InChIInChI=1S/C14H10Cl3N/c15-7-1-2-8-10(5-7)11(6-18)9-3-4-12(16)14(17)13(8)9/h1-5,11H,6,18H2
InChIKeyWTCVUVVEICCPDE-UHFFFAOYSA-N
XLogP4.72
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.60
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2,5,6-trichloro-9H-fluoren-9-yl)methanamine?
The IUPAC name of (2,5,6-trichloro-9H-fluoren-9-yl)methanamine (CID 82579380) is (2,5,6-trichloro-9H-fluoren-9-yl)methanamine.
What is the SMILES notation for (2,5,6-trichloro-9H-fluoren-9-yl)methanamine?
The canonical SMILES for (2,5,6-trichloro-9H-fluoren-9-yl)methanamine is NCC1c2cc(Cl)ccc2-c2c1ccc(Cl)c2Cl.
What is the InChIKey of (2,5,6-trichloro-9H-fluoren-9-yl)methanamine?
The InChIKey is WTCVUVVEICCPDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl3N/c15-7-1-2-8-10(5-7)11(6-18)9-3-4-12(16)14(17)13(8)9/h1-5,11H,6,18H2.
What are the key properties of (2,5,6-trichloro-9H-fluoren-9-yl)methanamine?
(2,5,6-trichloro-9H-fluoren-9-yl)methanamine has a molecular weight of 298.60 g/mol, XLogP of 4.72, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5,6-trichloro-9H-fluoren-9-yl)methanamine is sourced from PubChem (CID 82579380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).