2-methoxy-5-[4-methyl-6-(propylamino)pyrimidin-2-yl]phenol

C15H19N3O2 — CID 62203451

IUPAC2-methoxy-5-[4-methyl-6-(propylamino)pyrimidin-2-yl]phenol
SMILESCCCNc1cc(C)nc(-c2ccc(OC)c(O)c2)n1
InChIInChI=1S/C15H19N3O2/c1-4-7-16-14-8-10(2)17-15(18-14)11-5-6-13(20-3)12(19)9-11/h5-6,8-9,19H,4,7H2,1-3H3,(H,16,17,18)
InChIKeyROUUCEZGQARXLH-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.99
Rot. Bonds5

About 2-methoxy-5-[4-methyl-6-(propylamino)pyrimidin-2-yl]phenol

2-methoxy-5-[4-methyl-6-(propylamino)pyrimidin-2-yl]phenol (PubChem CID 62203451) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 2-methoxy-5-[4-methyl-6-(propylamino)pyrimidin-2-yl]phenol.

Molecular Properties

Compound Name2-methoxy-5-[4-methyl-6-(propylamino)pyrimidin-2-yl]phenol
PubChem CID62203451
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name2-methoxy-5-[4-methyl-6-(propylamino)pyrimidin-2-yl]phenol
SMILESCCCNc1cc(C)nc(-c2ccc(OC)c(O)c2)n1
InChIInChI=1S/C15H19N3O2/c1-4-7-16-14-8-10(2)17-15(18-14)11-5-6-13(20-3)12(19)9-11/h5-6,8-9,19H,4,7H2,1-3H3,(H,16,17,18)
InChIKeyROUUCEZGQARXLH-UHFFFAOYSA-N
XLogP2.99
TPSA67.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-chloro-4-[4-methyl-6-(propylamino)pyrimidin-2-yl]phenol
CID 135978603
2-(4-tert-butylphenyl)-6-methyl-N-propylpyrimidin-4-amine
CID 63485987
2-(2-methoxy-4-methylphenyl)-6-methyl-N-propylpyrimidin-4-amine
CID 106793012
6-methyl-2-(4-propan-2-yloxyphenyl)-N-propylpyrimidin-4-amine
CID 63485807
2-(4-bromo-3-fluorophenyl)-6-methyl-N-propylpyrimidin-4-amine
CID 81442424
2-(6-methoxypyridazin-3-yl)-6-methyl-N-propylpyrimidin-4-amine
CID 103374966
2-(4-methoxy-3-methylphenyl)-N,6-dimethylpyrimidin-4-amine
CID 62190799
6-methyl-N-propyl-2-(3,4,5-trifluorophenyl)pyrimidin-4-amine
CID 62190181
2-(3-chloro-4-methoxyphenyl)-N,6-dimethylpyrimidin-4-amine
CID 65022234
2-(6-methoxypyrimidin-4-yl)-6-methyl-N-propylpyrimidin-4-amine
CID 102952685
6-methyl-2-(2-methylphenyl)-N-propylpyrimidin-4-amine
CID 62192485
N-[[2-(3,4-dimethoxyphenyl)-6-methylpyrimidin-4-yl]methyl]ethanamine
CID 62744975

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-[4-methyl-6-(propylamino)pyrimidin-2-yl]phenol?
The IUPAC name of 2-methoxy-5-[4-methyl-6-(propylamino)pyrimidin-2-yl]phenol (CID 62203451) is 2-methoxy-5-[4-methyl-6-(propylamino)pyrimidin-2-yl]phenol.
What is the SMILES notation for 2-methoxy-5-[4-methyl-6-(propylamino)pyrimidin-2-yl]phenol?
The canonical SMILES for 2-methoxy-5-[4-methyl-6-(propylamino)pyrimidin-2-yl]phenol is CCCNc1cc(C)nc(-c2ccc(OC)c(O)c2)n1.
What is the InChIKey of 2-methoxy-5-[4-methyl-6-(propylamino)pyrimidin-2-yl]phenol?
The InChIKey is ROUUCEZGQARXLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-4-7-16-14-8-10(2)17-15(18-14)11-5-6-13(20-3)12(19)9-11/h5-6,8-9,19H,4,7H2,1-3H3,(H,16,17,18).
What are the key properties of 2-methoxy-5-[4-methyl-6-(propylamino)pyrimidin-2-yl]phenol?
2-methoxy-5-[4-methyl-6-(propylamino)pyrimidin-2-yl]phenol has a molecular weight of 273.34 g/mol, XLogP of 2.99, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-[4-methyl-6-(propylamino)pyrimidin-2-yl]phenol is sourced from PubChem (CID 62203451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).