5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyrimidin-2-amine

Name: 5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyrimidin-2-amine — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₁H₁₄FN₅O — CID 81342441

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

IUPAC5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyrimidin-2-amine

SMILESCCCNc1ncc(F)c(Oc2cc(C)[nH]n2)n1

InChIInChI=1S/C11H14FN5O/c1-3-4-13-11-14-6-8(12)10(15-11)18-9-5-7(2)16-17-9/h5-6H,3-4H2,1-2H3,(H,16,17)(H,13,14,15)

InChIKeyKNXKYWCRKYBDFA-UHFFFAOYSA-N

MW251.26 g/mol

LogP2.26

Rot. Bonds5

About 5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyrimidin-2-amine

5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyrimidin-2-amine (PubChem CID 81342441) has the molecular formula C₁₁H₁₄FN₅O and a molecular weight of 251.26 g/mol. Its IUPAC name is 5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyrimidin-2-amine.

Molecular Properties

Compound Name	5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyrimidin-2-amine
PubChem CID	81342441
Molecular Formula	C₁₁H₁₄FN₅O
Molecular Weight	251.26 g/mol
Exact Mass	251.12
IUPAC Name	5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyrimidin-2-amine
SMILES	CCCNc1ncc(F)c(Oc2cc(C)[nH]n2)n1
InChI	InChI=1S/C11H14FN5O/c1-3-4-13-11-14-6-8(12)10(15-11)18-9-5-7(2)16-17-9/h5-6H,3-4H2,1-2H3,(H,16,17)(H,13,14,15)
InChIKey	KNXKYWCRKYBDFA-UHFFFAOYSA-N
XLogP	2.26
TPSA	75.72 Å²
H-Bond Donors	2
H-Bond Acceptors	5
Rotatable Bonds	5
Heavy Atoms	18
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	251.26
LogP ≤ 5	2.26
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyrimidin-2-amine?

The IUPAC name of 5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyrimidin-2-amine (CID 81342441) is 5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyrimidin-2-amine.

What is the SMILES notation for 5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyrimidin-2-amine?

The canonical SMILES for 5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyrimidin-2-amine is CCCNc1ncc(F)c(Oc2cc(C)[nH]n2)n1.

What is the InChIKey of 5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyrimidin-2-amine?

The InChIKey is KNXKYWCRKYBDFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FN5O/c1-3-4-13-11-14-6-8(12)10(15-11)18-9-5-7(2)16-17-9/h5-6H,3-4H2,1-2H3,(H,16,17)(H,13,14,15).

What are the key properties of 5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyrimidin-2-amine?

5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyrimidin-2-amine has a molecular weight of 251.26 g/mol, XLogP of 2.26, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 5-fluoro-4-[(5-methyl-1H-pyrazol-3-yl)oxy]-N-propylpyrimidin-2-amine is sourced from PubChem (CID 81342441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 81342441 — identifiers, structure, computed properties (public domain)

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