2-N-Anilino-4-hydroxy-6-methylpyrimidine

Name: 2-N-Anilino-4-hydroxy-6-methylpyrimidine — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₁H₁₁N₃O — CID 135416215

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

IUPAC2-anilino-4-methyl-1H-pyrimidin-6-one

SMILESCc1cc(=O)[nH]c(Nc2ccccc2)n1

InChIInChI=1S/C11H11N3O/c1-8-7-10(15)14-11(12-8)13-9-5-3-2-4-6-9/h2-7H,1H3,(H2,12,13,14,15)

InChIKeyZQASUEBEKLHMME-UHFFFAOYSA-N

MW201.23 g/mol

LogP1.82

Rot. Bonds2

About 2-N-Anilino-4-hydroxy-6-methylpyrimidine

2-N-Anilino-4-hydroxy-6-methylpyrimidine (PubChem CID 135416215) has the molecular formula C₁₁H₁₁N₃O and a molecular weight of 201.23 g/mol. Its IUPAC name is 2-anilino-4-methyl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name	2-N-Anilino-4-hydroxy-6-methylpyrimidine
PubChem CID	135416215
Molecular Formula	C₁₁H₁₁N₃O
Molecular Weight	201.23 g/mol
Exact Mass	201.09
IUPAC Name	2-anilino-4-methyl-1H-pyrimidin-6-one
SMILES	Cc1cc(=O)[nH]c(Nc2ccccc2)n1
InChI	InChI=1S/C11H11N3O/c1-8-7-10(15)14-11(12-8)13-9-5-3-2-4-6-9/h2-7H,1H3,(H2,12,13,14,15)
InChIKey	ZQASUEBEKLHMME-UHFFFAOYSA-N
XLogP	1.82
TPSA	57.78 Å²
H-Bond Donors	2
H-Bond Acceptors	3
Rotatable Bonds	2
Heavy Atoms	15
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	201.23
LogP ≤ 5	1.82
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 2-N-Anilino-4-hydroxy-6-methylpyrimidine?

The IUPAC name of 2-N-Anilino-4-hydroxy-6-methylpyrimidine (CID 135416215) is 2-anilino-4-methyl-1H-pyrimidin-6-one.

What is the SMILES notation for 2-N-Anilino-4-hydroxy-6-methylpyrimidine?

The canonical SMILES for 2-N-Anilino-4-hydroxy-6-methylpyrimidine is Cc1cc(=O)[nH]c(Nc2ccccc2)n1.

What is the InChIKey of 2-N-Anilino-4-hydroxy-6-methylpyrimidine?

The InChIKey is ZQASUEBEKLHMME-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O/c1-8-7-10(15)14-11(12-8)13-9-5-3-2-4-6-9/h2-7H,1H3,(H2,12,13,14,15).

What are the key properties of 2-N-Anilino-4-hydroxy-6-methylpyrimidine?

2-N-Anilino-4-hydroxy-6-methylpyrimidine has a molecular weight of 201.23 g/mol, XLogP of 1.82, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 2-N-Anilino-4-hydroxy-6-methylpyrimidine is sourced from PubChem (CID 135416215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 135416215 — identifiers, structure, computed properties (public domain)

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