5-(2-amino-5-methoxypyrimidin-4-yl)-4-methoxypyrimidin-2-amine

C10H12N6O2 — CID 51063035

IUPAC5-(2-amino-5-methoxypyrimidin-4-yl)-4-methoxypyrimidin-2-amine
SMILESCOc1cnc(N)nc1-c1cnc(N)nc1OC
InChIInChI=1S/C10H12N6O2/c1-17-6-4-14-9(11)15-7(6)5-3-13-10(12)16-8(5)18-2/h3-4H,1-2H3,(H2,11,14,15)(H2,12,13,16)
InChIKeyJKWLBKKFWSBPGI-UHFFFAOYSA-N
MW248.25 g/mol
LogP0.12
Rot. Bonds3

About 5-(2-amino-5-methoxypyrimidin-4-yl)-4-methoxypyrimidin-2-amine

5-(2-amino-5-methoxypyrimidin-4-yl)-4-methoxypyrimidin-2-amine (PubChem CID 51063035) has the molecular formula C10H12N6O2 and a molecular weight of 248.25 g/mol. Its IUPAC name is 5-(2-amino-5-methoxypyrimidin-4-yl)-4-methoxypyrimidin-2-amine.

Molecular Properties

Compound Name5-(2-amino-5-methoxypyrimidin-4-yl)-4-methoxypyrimidin-2-amine
PubChem CID51063035
Molecular FormulaC10H12N6O2
Molecular Weight248.25 g/mol
Exact Mass248.10
IUPAC Name5-(2-amino-5-methoxypyrimidin-4-yl)-4-methoxypyrimidin-2-amine
SMILESCOc1cnc(N)nc1-c1cnc(N)nc1OC
InChIInChI=1S/C10H12N6O2/c1-17-6-4-14-9(11)15-7(6)5-3-13-10(12)16-8(5)18-2/h3-4H,1-2H3,(H2,11,14,15)(H2,12,13,16)
InChIKeyJKWLBKKFWSBPGI-UHFFFAOYSA-N
XLogP0.12
TPSA122.06 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.25
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

4,5-dimethoxypyrimidin-2-amine
CID 12988104
2-amino-5-methoxypyrimidine-4-carboxylic acid
CID 83816093
4-methoxy-5-[4-(4-methylpyridazin-3-yl)phenyl]pyrimidin-2-amine
CID 155404797
5-but-2-en-2-yl-4-methoxypyrimidin-2-amine
CID 123348175
5-(2-aminoethyl)-4-methoxypyrimidin-2-amine
CID 83851815
4-(2,2-dimethylpropyl)-5-methoxypyrimidin-2-amine
CID 165484904
5-butyl-4-methoxypyrimidin-2-amine
CID 13301093
4-(6-bromo-3-methoxy-2-pyridinyl)-5-methylpyrimidin-2-amine
CID 122486165
4-(6-bromo-3-methoxy-2-pyridinyl)-5-propan-2-ylpyrimidin-2-amine
CID 122486173
5-(3,4,5-trimethoxyphenoxy)pyrimidine-2,4-diamine
CID 626130
2-[2-amino-5-(2-methoxyphenoxy)pyrimidin-4-yl]-5-(2-methylprop-2-enoxy)phenol
CID 665714
5-(5-methoxy-6-methyl-3-propan-2-ylpyrazin-2-yl)oxypyrimidine-2,4-diamine
CID 145374317

Frequently Asked Questions

What is the IUPAC name of 5-(2-amino-5-methoxypyrimidin-4-yl)-4-methoxypyrimidin-2-amine?
The IUPAC name of 5-(2-amino-5-methoxypyrimidin-4-yl)-4-methoxypyrimidin-2-amine (CID 51063035) is 5-(2-amino-5-methoxypyrimidin-4-yl)-4-methoxypyrimidin-2-amine.
What is the SMILES notation for 5-(2-amino-5-methoxypyrimidin-4-yl)-4-methoxypyrimidin-2-amine?
The canonical SMILES for 5-(2-amino-5-methoxypyrimidin-4-yl)-4-methoxypyrimidin-2-amine is COc1cnc(N)nc1-c1cnc(N)nc1OC.
What is the InChIKey of 5-(2-amino-5-methoxypyrimidin-4-yl)-4-methoxypyrimidin-2-amine?
The InChIKey is JKWLBKKFWSBPGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N6O2/c1-17-6-4-14-9(11)15-7(6)5-3-13-10(12)16-8(5)18-2/h3-4H,1-2H3,(H2,11,14,15)(H2,12,13,16).
What are the key properties of 5-(2-amino-5-methoxypyrimidin-4-yl)-4-methoxypyrimidin-2-amine?
5-(2-amino-5-methoxypyrimidin-4-yl)-4-methoxypyrimidin-2-amine has a molecular weight of 248.25 g/mol, XLogP of 0.12, 3 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-amino-5-methoxypyrimidin-4-yl)-4-methoxypyrimidin-2-amine is sourced from PubChem (CID 51063035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).