4-amino-1,2,3,4-tetrahydropyrimidin-2-ol

C4H9N3O — CID 89255787

IUPAC4-amino-1,2,3,4-tetrahydropyrimidin-2-ol
SMILESNC1C=CNC(O)N1
InChIInChI=1S/C4H9N3O/c5-3-1-2-6-4(8)7-3/h1-4,6-8H,5H2
InChIKeyZUZMAFWLRQDZNH-UHFFFAOYSA-N
MW115.14 g/mol
LogP-1.75
Rot. Bonds

About 4-amino-1,2,3,4-tetrahydropyrimidin-2-ol

4-amino-1,2,3,4-tetrahydropyrimidin-2-ol (PubChem CID 89255787) has the molecular formula C4H9N3O and a molecular weight of 115.14 g/mol. Its IUPAC name is 4-amino-1,2,3,4-tetrahydropyrimidin-2-ol.

Molecular Properties

Compound Name4-amino-1,2,3,4-tetrahydropyrimidin-2-ol
PubChem CID89255787
Molecular FormulaC4H9N3O
Molecular Weight115.14 g/mol
Exact Mass115.07
IUPAC Name4-amino-1,2,3,4-tetrahydropyrimidin-2-ol
SMILESNC1C=CNC(O)N1
InChIInChI=1S/C4H9N3O/c5-3-1-2-6-4(8)7-3/h1-4,6-8H,5H2
InChIKeyZUZMAFWLRQDZNH-UHFFFAOYSA-N
XLogP-1.75
TPSA70.31 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.14
LogP ≤ 5-1.75
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-1,2,3,4-tetrahydropyrimidin-2-ol?
The IUPAC name of 4-amino-1,2,3,4-tetrahydropyrimidin-2-ol (CID 89255787) is 4-amino-1,2,3,4-tetrahydropyrimidin-2-ol.
What is the SMILES notation for 4-amino-1,2,3,4-tetrahydropyrimidin-2-ol?
The canonical SMILES for 4-amino-1,2,3,4-tetrahydropyrimidin-2-ol is NC1C=CNC(O)N1.
What is the InChIKey of 4-amino-1,2,3,4-tetrahydropyrimidin-2-ol?
The InChIKey is ZUZMAFWLRQDZNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9N3O/c5-3-1-2-6-4(8)7-3/h1-4,6-8H,5H2.
What are the key properties of 4-amino-1,2,3,4-tetrahydropyrimidin-2-ol?
4-amino-1,2,3,4-tetrahydropyrimidin-2-ol has a molecular weight of 115.14 g/mol, XLogP of -1.75, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1,2,3,4-tetrahydropyrimidin-2-ol is sourced from PubChem (CID 89255787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).