3-(4,6-dimethoxypyrimidin-2-yl)oxypyridin-2-amine

C11H12N4O3 — CID 52934007

IUPAC3-(4,6-dimethoxypyrimidin-2-yl)oxypyridin-2-amine
SMILESCOc1cc(OC)nc(Oc2cccnc2N)n1
InChIInChI=1S/C11H12N4O3/c1-16-8-6-9(17-2)15-11(14-8)18-7-4-3-5-13-10(7)12/h3-6H,1-2H3,(H2,12,13)
InChIKeyVWKFWDSPYAVUFA-UHFFFAOYSA-N
MW248.24 g/mol
LogP1.26
Rot. Bonds4

About 3-(4,6-dimethoxypyrimidin-2-yl)oxypyridin-2-amine

3-(4,6-dimethoxypyrimidin-2-yl)oxypyridin-2-amine (PubChem CID 52934007) has the molecular formula C11H12N4O3 and a molecular weight of 248.24 g/mol. Its IUPAC name is 3-(4,6-dimethoxypyrimidin-2-yl)oxypyridin-2-amine.

Molecular Properties

Compound Name3-(4,6-dimethoxypyrimidin-2-yl)oxypyridin-2-amine
PubChem CID52934007
Molecular FormulaC11H12N4O3
Molecular Weight248.24 g/mol
Exact Mass248.09
IUPAC Name3-(4,6-dimethoxypyrimidin-2-yl)oxypyridin-2-amine
SMILESCOc1cc(OC)nc(Oc2cccnc2N)n1
InChIInChI=1S/C11H12N4O3/c1-16-8-6-9(17-2)15-11(14-8)18-7-4-3-5-13-10(7)12/h3-6H,1-2H3,(H2,12,13)
InChIKeyVWKFWDSPYAVUFA-UHFFFAOYSA-N
XLogP1.26
TPSA92.38 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.24
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

(3-Ethoxy-pyridin-2-yl)-pyridin-2-yl-amine
CID 11321863
(3-Ethoxy-pyridin-2-yl)-(6-methoxy-pyridin-2-yl)-amine
CID 11149253
(3-Ethoxy-pyridin-2-yl)-(6-methyl-pyridin-2-yl)-amine
CID 11368190
3-ethoxy-N-(6-methylpyridin-2-yl)-5-(pyridin-3-yloxy)pyridin-2-amine
CID 11381681
(3-Methoxy-pyridin-2-yl)-(6-methyl-pyridin-2-yl)-amine
CID 11413259
4-N-butyl-5-[(3,4-dimethoxy-2-pyridinyl)methoxy]pyrimidine-2,4-diamine
CID 66575872
US10266549, Example 230
CID 118905528
2-Amino-3-methoxypyridine
CID 9920384
4-(2,2-Dimethylpropylamino)-5-(3-pyridin-3-yloxyprop-1-ynyl)pyrimidine-2-carbonitrile
CID 10471316
Propan-2-yl 4-[5-methyl-6-[(4-methyl-3-pyridinyl)oxy]pyrimidin-4-yl]oxypiperidine-1-carboxylate
CID 57397674
N-[5-[2-(dimethylamino)ethoxy]-2-pyridinyl]-6-imidazol-1-ylpyrimidin-4-amine
CID 134139906
(6-Methyl-pyridin-2-yl)-(3-propoxy-pyridin-2-yl)-amine
CID 11368523

Frequently Asked Questions

What is the IUPAC name of 3-(4,6-dimethoxypyrimidin-2-yl)oxypyridin-2-amine?
The IUPAC name of 3-(4,6-dimethoxypyrimidin-2-yl)oxypyridin-2-amine (CID 52934007) is 3-(4,6-dimethoxypyrimidin-2-yl)oxypyridin-2-amine.
What is the SMILES notation for 3-(4,6-dimethoxypyrimidin-2-yl)oxypyridin-2-amine?
The canonical SMILES for 3-(4,6-dimethoxypyrimidin-2-yl)oxypyridin-2-amine is COc1cc(OC)nc(Oc2cccnc2N)n1.
What is the InChIKey of 3-(4,6-dimethoxypyrimidin-2-yl)oxypyridin-2-amine?
The InChIKey is VWKFWDSPYAVUFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O3/c1-16-8-6-9(17-2)15-11(14-8)18-7-4-3-5-13-10(7)12/h3-6H,1-2H3,(H2,12,13).
What are the key properties of 3-(4,6-dimethoxypyrimidin-2-yl)oxypyridin-2-amine?
3-(4,6-dimethoxypyrimidin-2-yl)oxypyridin-2-amine has a molecular weight of 248.24 g/mol, XLogP of 1.26, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,6-dimethoxypyrimidin-2-yl)oxypyridin-2-amine is sourced from PubChem (CID 52934007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).