2-[(4-fluoro-2-methylphenyl)methyl]-5-methylpyrazol-3-amine

Name: 2-[(4-fluoro-2-methylphenyl)methyl]-5-methylpyrazol-3-amine — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₂H₁₄FN₃ — CID 62136321

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC2-[(4-fluoro-2-methylphenyl)methyl]-5-methylpyrazol-3-amine

SMILESCc1cc(N)n(Cc2ccc(F)cc2C)n1

InChIInChI=1S/C12H14FN3/c1-8-5-11(13)4-3-10(8)7-16-12(14)6-9(2)15-16/h3-6H,7,14H2,1-2H3

InChIKeyGCCQEKLGHONZBC-UHFFFAOYSA-N

MW219.26 g/mol

LogP2.27

Rot. Bonds2

About 2-[(4-fluoro-2-methylphenyl)methyl]-5-methylpyrazol-3-amine

2-[(4-fluoro-2-methylphenyl)methyl]-5-methylpyrazol-3-amine (PubChem CID 62136321) has the molecular formula C₁₂H₁₄FN₃ and a molecular weight of 219.26 g/mol. Its IUPAC name is 2-[(4-fluoro-2-methylphenyl)methyl]-5-methylpyrazol-3-amine.

Molecular Properties

Compound Name	2-[(4-fluoro-2-methylphenyl)methyl]-5-methylpyrazol-3-amine
PubChem CID	62136321
Molecular Formula	C₁₂H₁₄FN₃
Molecular Weight	219.26 g/mol
Exact Mass	219.12
IUPAC Name	2-[(4-fluoro-2-methylphenyl)methyl]-5-methylpyrazol-3-amine
SMILES	Cc1cc(N)n(Cc2ccc(F)cc2C)n1
InChI	InChI=1S/C12H14FN3/c1-8-5-11(13)4-3-10(8)7-16-12(14)6-9(2)15-16/h3-6H,7,14H2,1-2H3
InChIKey	GCCQEKLGHONZBC-UHFFFAOYSA-N
XLogP	2.27
TPSA	43.84 Å²
H-Bond Donors	1
H-Bond Acceptors	3
Rotatable Bonds	2
Heavy Atoms	16
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	219.26
LogP ≤ 5	2.27
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluoro-2-methylphenyl)methyl]-5-methylpyrazol-3-amine?

The IUPAC name of 2-[(4-fluoro-2-methylphenyl)methyl]-5-methylpyrazol-3-amine (CID 62136321) is 2-[(4-fluoro-2-methylphenyl)methyl]-5-methylpyrazol-3-amine.

What is the SMILES notation for 2-[(4-fluoro-2-methylphenyl)methyl]-5-methylpyrazol-3-amine?

The canonical SMILES for 2-[(4-fluoro-2-methylphenyl)methyl]-5-methylpyrazol-3-amine is Cc1cc(N)n(Cc2ccc(F)cc2C)n1.

What is the InChIKey of 2-[(4-fluoro-2-methylphenyl)methyl]-5-methylpyrazol-3-amine?

The InChIKey is GCCQEKLGHONZBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FN3/c1-8-5-11(13)4-3-10(8)7-16-12(14)6-9(2)15-16/h3-6H,7,14H2,1-2H3.

What are the key properties of 2-[(4-fluoro-2-methylphenyl)methyl]-5-methylpyrazol-3-amine?

2-[(4-fluoro-2-methylphenyl)methyl]-5-methylpyrazol-3-amine has a molecular weight of 219.26 g/mol, XLogP of 2.27, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(4-fluoro-2-methylphenyl)methyl]-5-methylpyrazol-3-amine is sourced from PubChem (CID 62136321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 62136321 — identifiers, structure, computed properties (public domain)

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