3-fluoro-N-[(2-methylpyrazol-3-yl)methyl]pyridin-2-amine

C10H11FN4 — CID 63302427

IUPAC3-fluoro-N-[(2-methylpyrazol-3-yl)methyl]pyridin-2-amine
SMILESCn1nccc1CNc1ncccc1F
InChIInChI=1S/C10H11FN4/c1-15-8(4-6-14-15)7-13-10-9(11)3-2-5-12-10/h2-6H,7H2,1H3,(H,12,13)
InChIKeyAUWOTGISPAFGOD-UHFFFAOYSA-N
MW206.22 g/mol
LogP1.57
Rot. Bonds3

About 3-fluoro-N-[(2-methylpyrazol-3-yl)methyl]pyridin-2-amine

3-fluoro-N-[(2-methylpyrazol-3-yl)methyl]pyridin-2-amine (PubChem CID 63302427) has the molecular formula C10H11FN4 and a molecular weight of 206.22 g/mol. Its IUPAC name is 3-fluoro-N-[(2-methylpyrazol-3-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name3-fluoro-N-[(2-methylpyrazol-3-yl)methyl]pyridin-2-amine
PubChem CID63302427
Molecular FormulaC10H11FN4
Molecular Weight206.22 g/mol
Exact Mass206.10
IUPAC Name3-fluoro-N-[(2-methylpyrazol-3-yl)methyl]pyridin-2-amine
SMILESCn1nccc1CNc1ncccc1F
InChIInChI=1S/C10H11FN4/c1-15-8(4-6-14-15)7-13-10-9(11)3-2-5-12-10/h2-6H,7H2,1H3,(H,12,13)
InChIKeyAUWOTGISPAFGOD-UHFFFAOYSA-N
XLogP1.57
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.22
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[(2-methylpyrazol-3-yl)methyl]pyridin-2-amine?
The IUPAC name of 3-fluoro-N-[(2-methylpyrazol-3-yl)methyl]pyridin-2-amine (CID 63302427) is 3-fluoro-N-[(2-methylpyrazol-3-yl)methyl]pyridin-2-amine.
What is the SMILES notation for 3-fluoro-N-[(2-methylpyrazol-3-yl)methyl]pyridin-2-amine?
The canonical SMILES for 3-fluoro-N-[(2-methylpyrazol-3-yl)methyl]pyridin-2-amine is Cn1nccc1CNc1ncccc1F.
What is the InChIKey of 3-fluoro-N-[(2-methylpyrazol-3-yl)methyl]pyridin-2-amine?
The InChIKey is AUWOTGISPAFGOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN4/c1-15-8(4-6-14-15)7-13-10-9(11)3-2-5-12-10/h2-6H,7H2,1H3,(H,12,13).
What are the key properties of 3-fluoro-N-[(2-methylpyrazol-3-yl)methyl]pyridin-2-amine?
3-fluoro-N-[(2-methylpyrazol-3-yl)methyl]pyridin-2-amine has a molecular weight of 206.22 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[(2-methylpyrazol-3-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 63302427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).