4-amino-2-hydroxy-3-propyl-1,2-dihydropyrimidin-6-one

C7H13N3O2 — CID 143634310

IUPAC4-amino-2-hydroxy-3-propyl-1,2-dihydropyrimidin-6-one
SMILESCCCN1C(N)=CC(=O)NC1O
InChIInChI=1S/C7H13N3O2/c1-2-3-10-5(8)4-6(11)9-7(10)12/h4,7,12H,2-3,8H2,1H3,(H,9,11)
InChIKeyXHILJQGWDPDKOL-UHFFFAOYSA-N
MW171.20 g/mol
LogP-1.10
Rot. Bonds2

About 4-amino-2-hydroxy-3-propyl-1,2-dihydropyrimidin-6-one

4-amino-2-hydroxy-3-propyl-1,2-dihydropyrimidin-6-one (PubChem CID 143634310) has the molecular formula C7H13N3O2 and a molecular weight of 171.20 g/mol. Its IUPAC name is 4-amino-2-hydroxy-3-propyl-1,2-dihydropyrimidin-6-one.

Molecular Properties

Compound Name4-amino-2-hydroxy-3-propyl-1,2-dihydropyrimidin-6-one
PubChem CID143634310
Molecular FormulaC7H13N3O2
Molecular Weight171.20 g/mol
Exact Mass171.10
IUPAC Name4-amino-2-hydroxy-3-propyl-1,2-dihydropyrimidin-6-one
SMILESCCCN1C(N)=CC(=O)NC1O
InChIInChI=1S/C7H13N3O2/c1-2-3-10-5(8)4-6(11)9-7(10)12/h4,7,12H,2-3,8H2,1H3,(H,9,11)
InChIKeyXHILJQGWDPDKOL-UHFFFAOYSA-N
XLogP-1.10
TPSA78.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.20
LogP ≤ 5-1.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-2-hydroxy-3-propyl-1,2-dihydropyrimidin-6-one?
The IUPAC name of 4-amino-2-hydroxy-3-propyl-1,2-dihydropyrimidin-6-one (CID 143634310) is 4-amino-2-hydroxy-3-propyl-1,2-dihydropyrimidin-6-one.
What is the SMILES notation for 4-amino-2-hydroxy-3-propyl-1,2-dihydropyrimidin-6-one?
The canonical SMILES for 4-amino-2-hydroxy-3-propyl-1,2-dihydropyrimidin-6-one is CCCN1C(N)=CC(=O)NC1O.
What is the InChIKey of 4-amino-2-hydroxy-3-propyl-1,2-dihydropyrimidin-6-one?
The InChIKey is XHILJQGWDPDKOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O2/c1-2-3-10-5(8)4-6(11)9-7(10)12/h4,7,12H,2-3,8H2,1H3,(H,9,11).
What are the key properties of 4-amino-2-hydroxy-3-propyl-1,2-dihydropyrimidin-6-one?
4-amino-2-hydroxy-3-propyl-1,2-dihydropyrimidin-6-one has a molecular weight of 171.20 g/mol, XLogP of -1.10, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-hydroxy-3-propyl-1,2-dihydropyrimidin-6-one is sourced from PubChem (CID 143634310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).