4-(9H-fluoren-2-yl)pyrimidin-2-amine

C17H13N3 — CID 54468261

IUPAC4-(9H-fluoren-2-yl)pyrimidin-2-amine
SMILESNc1nccc(-c2ccc3c(c2)Cc2ccccc2-3)n1
InChIInChI=1S/C17H13N3/c18-17-19-8-7-16(20-17)12-5-6-15-13(10-12)9-11-3-1-2-4-14(11)15/h1-8,10H,9H2,(H2,18,19,20)
InChIKeyXGMJUENYCJASKV-UHFFFAOYSA-N
MW259.31 g/mol
LogP3.30
Rot. Bonds1

About 4-(9H-fluoren-2-yl)pyrimidin-2-amine

4-(9H-fluoren-2-yl)pyrimidin-2-amine (PubChem CID 54468261) has the molecular formula C17H13N3 and a molecular weight of 259.31 g/mol. Its IUPAC name is 4-(9H-fluoren-2-yl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-(9H-fluoren-2-yl)pyrimidin-2-amine
PubChem CID54468261
Molecular FormulaC17H13N3
Molecular Weight259.31 g/mol
Exact Mass259.11
IUPAC Name4-(9H-fluoren-2-yl)pyrimidin-2-amine
SMILESNc1nccc(-c2ccc3c(c2)Cc2ccccc2-3)n1
InChIInChI=1S/C17H13N3/c18-17-19-8-7-16(20-17)12-5-6-15-13(10-12)9-11-3-1-2-4-14(11)15/h1-8,10H,9H2,(H2,18,19,20)
InChIKeyXGMJUENYCJASKV-UHFFFAOYSA-N
XLogP3.30
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(9H-fluoren-2-yl)pyrimidin-2-amine?
The IUPAC name of 4-(9H-fluoren-2-yl)pyrimidin-2-amine (CID 54468261) is 4-(9H-fluoren-2-yl)pyrimidin-2-amine.
What is the SMILES notation for 4-(9H-fluoren-2-yl)pyrimidin-2-amine?
The canonical SMILES for 4-(9H-fluoren-2-yl)pyrimidin-2-amine is Nc1nccc(-c2ccc3c(c2)Cc2ccccc2-3)n1.
What is the InChIKey of 4-(9H-fluoren-2-yl)pyrimidin-2-amine?
The InChIKey is XGMJUENYCJASKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N3/c18-17-19-8-7-16(20-17)12-5-6-15-13(10-12)9-11-3-1-2-4-14(11)15/h1-8,10H,9H2,(H2,18,19,20).
What are the key properties of 4-(9H-fluoren-2-yl)pyrimidin-2-amine?
4-(9H-fluoren-2-yl)pyrimidin-2-amine has a molecular weight of 259.31 g/mol, XLogP of 3.30, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(9H-fluoren-2-yl)pyrimidin-2-amine is sourced from PubChem (CID 54468261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).