6-(methoxymethyl)-N-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-amine

C13H16N4O — CID 55086950

IUPAC6-(methoxymethyl)-N-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-amine
SMILESCNc1cc(COC)nc(Cc2cccnc2)n1
InChIInChI=1S/C13H16N4O/c1-14-12-7-11(9-18-2)16-13(17-12)6-10-4-3-5-15-8-10/h3-5,7-8H,6,9H2,1-2H3,(H,14,16,17)
InChIKeyVMWSQKIHYFWDGZ-UHFFFAOYSA-N
MW244.30 g/mol
LogP1.65
Rot. Bonds5

About 6-(methoxymethyl)-N-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-amine

6-(methoxymethyl)-N-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-amine (PubChem CID 55086950) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is 6-(methoxymethyl)-N-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-(methoxymethyl)-N-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-amine
PubChem CID55086950
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC Name6-(methoxymethyl)-N-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-amine
SMILESCNc1cc(COC)nc(Cc2cccnc2)n1
InChIInChI=1S/C13H16N4O/c1-14-12-7-11(9-18-2)16-13(17-12)6-10-4-3-5-15-8-10/h3-5,7-8H,6,9H2,1-2H3,(H,14,16,17)
InChIKeyVMWSQKIHYFWDGZ-UHFFFAOYSA-N
XLogP1.65
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(methoxymethyl)-2-[(3-methoxyphenyl)methyl]-N-methylpyrimidin-4-amine
CID 62319868
N-methyl-2-propyl-6-(pyridin-3-ylmethyl)pyrimidin-4-amine
CID 104737132
6-(methoxymethyl)-N-methyl-2-(phenoxymethyl)pyrimidin-4-amine
CID 62716726
6-(methoxymethyl)-N-methyl-2-[(2-methylphenyl)methyl]pyrimidin-4-amine
CID 55062684
2-[(2,6-dichlorophenyl)methyl]-6-(methoxymethyl)-N-methylpyrimidin-4-amine
CID 62319495
2-benzyl-6-(methoxymethyl)-N-propylpyrimidin-4-amine
CID 62320410
6-(methoxymethyl)-N-propyl-2-(pyridin-4-ylmethyl)pyrimidin-4-amine
CID 62552293
6-(methoxymethyl)-N-methyl-2-(phenylsulfanylmethyl)pyrimidin-4-amine
CID 65143448
6-(methoxymethyl)-2-(3-methoxypropyl)-N-methylpyrimidin-4-amine
CID 65091955
N-ethyl-2-propyl-6-(pyridin-3-ylmethyl)pyrimidin-4-amine
CID 104737131
2-[(2-chloro-6-fluorophenyl)methyl]-6-(methoxymethyl)-N-methylpyrimidin-4-amine
CID 63022494
2-[(3-chlorophenyl)methyl]-N-ethyl-6-(methoxymethyl)pyrimidin-4-amine
CID 62320406

Frequently Asked Questions

What is the IUPAC name of 6-(methoxymethyl)-N-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-amine?
The IUPAC name of 6-(methoxymethyl)-N-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-amine (CID 55086950) is 6-(methoxymethyl)-N-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-(methoxymethyl)-N-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-amine?
The canonical SMILES for 6-(methoxymethyl)-N-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-amine is CNc1cc(COC)nc(Cc2cccnc2)n1.
What is the InChIKey of 6-(methoxymethyl)-N-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-amine?
The InChIKey is VMWSQKIHYFWDGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O/c1-14-12-7-11(9-18-2)16-13(17-12)6-10-4-3-5-15-8-10/h3-5,7-8H,6,9H2,1-2H3,(H,14,16,17).
What are the key properties of 6-(methoxymethyl)-N-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-amine?
6-(methoxymethyl)-N-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-amine has a molecular weight of 244.30 g/mol, XLogP of 1.65, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methoxymethyl)-N-methyl-2-(pyridin-3-ylmethyl)pyrimidin-4-amine is sourced from PubChem (CID 55086950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).