5-methyl-1,2-dihydropyrimidin-2-amine

C5H9N3 — CID 118258732

IUPAC5-methyl-1,2-dihydropyrimidin-2-amine
SMILESCC1=CNC(N)N=C1
InChIInChI=1S/C5H9N3/c1-4-2-7-5(6)8-3-4/h2-3,5,7H,6H2,1H3
InChIKeySFRPLLMILUCFRR-UHFFFAOYSA-N
MW111.15 g/mol
LogP-0.19
Rot. Bonds

About 5-methyl-1,2-dihydropyrimidin-2-amine

5-methyl-1,2-dihydropyrimidin-2-amine (PubChem CID 118258732) has the molecular formula C5H9N3 and a molecular weight of 111.15 g/mol. Its IUPAC name is 5-methyl-1,2-dihydropyrimidin-2-amine.

Molecular Properties

Compound Name5-methyl-1,2-dihydropyrimidin-2-amine
PubChem CID118258732
Molecular FormulaC5H9N3
Molecular Weight111.15 g/mol
Exact Mass111.08
IUPAC Name5-methyl-1,2-dihydropyrimidin-2-amine
SMILESCC1=CNC(N)N=C1
InChIInChI=1S/C5H9N3/c1-4-2-7-5(6)8-3-4/h2-3,5,7H,6H2,1H3
InChIKeySFRPLLMILUCFRR-UHFFFAOYSA-N
XLogP-0.19
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.15
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-1,2-dihydropyrimidin-2-amine?
The IUPAC name of 5-methyl-1,2-dihydropyrimidin-2-amine (CID 118258732) is 5-methyl-1,2-dihydropyrimidin-2-amine.
What is the SMILES notation for 5-methyl-1,2-dihydropyrimidin-2-amine?
The canonical SMILES for 5-methyl-1,2-dihydropyrimidin-2-amine is CC1=CNC(N)N=C1.
What is the InChIKey of 5-methyl-1,2-dihydropyrimidin-2-amine?
The InChIKey is SFRPLLMILUCFRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3/c1-4-2-7-5(6)8-3-4/h2-3,5,7H,6H2,1H3.
What are the key properties of 5-methyl-1,2-dihydropyrimidin-2-amine?
5-methyl-1,2-dihydropyrimidin-2-amine has a molecular weight of 111.15 g/mol, XLogP of -0.19, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1,2-dihydropyrimidin-2-amine is sourced from PubChem (CID 118258732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).