N-[(2-fluorophenyl)methyl]-6-pyrazol-1-ylpyridin-3-amine

C15H13FN4 — CID 43704514

IUPACN-[(2-fluorophenyl)methyl]-6-pyrazol-1-ylpyridin-3-amine
SMILESFc1ccccc1CNc1ccc(-n2cccn2)nc1
InChIInChI=1S/C15H13FN4/c16-14-5-2-1-4-12(14)10-17-13-6-7-15(18-11-13)20-9-3-8-19-20/h1-9,11,17H,10H2
InChIKeyLSFKEQXFPRRURP-UHFFFAOYSA-N
MW268.30 g/mol
LogP3.02
Rot. Bonds4

About N-[(2-fluorophenyl)methyl]-6-pyrazol-1-ylpyridin-3-amine

N-[(2-fluorophenyl)methyl]-6-pyrazol-1-ylpyridin-3-amine (PubChem CID 43704514) has the molecular formula C15H13FN4 and a molecular weight of 268.30 g/mol. Its IUPAC name is N-[(2-fluorophenyl)methyl]-6-pyrazol-1-ylpyridin-3-amine.

Molecular Properties

Compound NameN-[(2-fluorophenyl)methyl]-6-pyrazol-1-ylpyridin-3-amine
PubChem CID43704514
Molecular FormulaC15H13FN4
Molecular Weight268.30 g/mol
Exact Mass268.11
IUPAC NameN-[(2-fluorophenyl)methyl]-6-pyrazol-1-ylpyridin-3-amine
SMILESFc1ccccc1CNc1ccc(-n2cccn2)nc1
InChIInChI=1S/C15H13FN4/c16-14-5-2-1-4-12(14)10-17-13-6-7-15(18-11-13)20-9-3-8-19-20/h1-9,11,17H,10H2
InChIKeyLSFKEQXFPRRURP-UHFFFAOYSA-N
XLogP3.02
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.30
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(2-fluorophenyl)methyl]-6-pyrazol-1-ylpyridin-3-amine?
The IUPAC name of N-[(2-fluorophenyl)methyl]-6-pyrazol-1-ylpyridin-3-amine (CID 43704514) is N-[(2-fluorophenyl)methyl]-6-pyrazol-1-ylpyridin-3-amine.
What is the SMILES notation for N-[(2-fluorophenyl)methyl]-6-pyrazol-1-ylpyridin-3-amine?
The canonical SMILES for N-[(2-fluorophenyl)methyl]-6-pyrazol-1-ylpyridin-3-amine is Fc1ccccc1CNc1ccc(-n2cccn2)nc1.
What is the InChIKey of N-[(2-fluorophenyl)methyl]-6-pyrazol-1-ylpyridin-3-amine?
The InChIKey is LSFKEQXFPRRURP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN4/c16-14-5-2-1-4-12(14)10-17-13-6-7-15(18-11-13)20-9-3-8-19-20/h1-9,11,17H,10H2.
What are the key properties of N-[(2-fluorophenyl)methyl]-6-pyrazol-1-ylpyridin-3-amine?
N-[(2-fluorophenyl)methyl]-6-pyrazol-1-ylpyridin-3-amine has a molecular weight of 268.30 g/mol, XLogP of 3.02, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-fluorophenyl)methyl]-6-pyrazol-1-ylpyridin-3-amine is sourced from PubChem (CID 43704514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).