4-(methoxymethyl)-6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine

C7H15N3O — CID 146674814

IUPAC4-(methoxymethyl)-6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine
SMILESCOCC1CC(C)NC(N)=N1
InChIInChI=1S/C7H15N3O/c1-5-3-6(4-11-2)10-7(8)9-5/h5-6H,3-4H2,1-2H3,(H3,8,9,10)
InChIKeyFMIDYEQZUVESSK-UHFFFAOYSA-N
MW157.22 g/mol
LogP-0.30
Rot. Bonds2

About 4-(methoxymethyl)-6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine

4-(methoxymethyl)-6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine (PubChem CID 146674814) has the molecular formula C7H15N3O and a molecular weight of 157.22 g/mol. Its IUPAC name is 4-(methoxymethyl)-6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine.

Molecular Properties

Compound Name4-(methoxymethyl)-6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine
PubChem CID146674814
Molecular FormulaC7H15N3O
Molecular Weight157.22 g/mol
Exact Mass157.12
IUPAC Name4-(methoxymethyl)-6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine
SMILESCOCC1CC(C)NC(N)=N1
InChIInChI=1S/C7H15N3O/c1-5-3-6(4-11-2)10-7(8)9-5/h5-6H,3-4H2,1-2H3,(H3,8,9,10)
InChIKeyFMIDYEQZUVESSK-UHFFFAOYSA-N
XLogP-0.30
TPSA59.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.22
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine?
The IUPAC name of 4-(methoxymethyl)-6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine (CID 146674814) is 4-(methoxymethyl)-6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine.
What is the SMILES notation for 4-(methoxymethyl)-6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine?
The canonical SMILES for 4-(methoxymethyl)-6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine is COCC1CC(C)NC(N)=N1.
What is the InChIKey of 4-(methoxymethyl)-6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine?
The InChIKey is FMIDYEQZUVESSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3O/c1-5-3-6(4-11-2)10-7(8)9-5/h5-6H,3-4H2,1-2H3,(H3,8,9,10).
What are the key properties of 4-(methoxymethyl)-6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine?
4-(methoxymethyl)-6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine has a molecular weight of 157.22 g/mol, XLogP of -0.30, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-6-methyl-1,4,5,6-tetrahydropyrimidin-2-amine is sourced from PubChem (CID 146674814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).