1-amino-3-pyrimidin-2-ylpropan-2-ol

C7H11N3O — CID 83442577

IUPAC1-amino-3-pyrimidin-2-ylpropan-2-ol
SMILESNCC(O)Cc1ncccn1
InChIInChI=1S/C7H11N3O/c8-5-6(11)4-7-9-2-1-3-10-7/h1-3,6,11H,4-5,8H2
InChIKeyUVAYZIZWBVURPB-UHFFFAOYSA-N
MW153.19 g/mol
LogP-0.66
Rot. Bonds3

About 1-amino-3-pyrimidin-2-ylpropan-2-ol

1-amino-3-pyrimidin-2-ylpropan-2-ol (PubChem CID 83442577) has the molecular formula C7H11N3O and a molecular weight of 153.19 g/mol. Its IUPAC name is 1-amino-3-pyrimidin-2-ylpropan-2-ol.

Molecular Properties

Compound Name1-amino-3-pyrimidin-2-ylpropan-2-ol
PubChem CID83442577
Molecular FormulaC7H11N3O
Molecular Weight153.19 g/mol
Exact Mass153.09
IUPAC Name1-amino-3-pyrimidin-2-ylpropan-2-ol
SMILESNCC(O)Cc1ncccn1
InChIInChI=1S/C7H11N3O/c8-5-6(11)4-7-9-2-1-3-10-7/h1-3,6,11H,4-5,8H2
InChIKeyUVAYZIZWBVURPB-UHFFFAOYSA-N
XLogP-0.66
TPSA72.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.19
LogP ≤ 5-0.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-amino-3-pyrimidin-2-ylpropan-2-ol?
The IUPAC name of 1-amino-3-pyrimidin-2-ylpropan-2-ol (CID 83442577) is 1-amino-3-pyrimidin-2-ylpropan-2-ol.
What is the SMILES notation for 1-amino-3-pyrimidin-2-ylpropan-2-ol?
The canonical SMILES for 1-amino-3-pyrimidin-2-ylpropan-2-ol is NCC(O)Cc1ncccn1.
What is the InChIKey of 1-amino-3-pyrimidin-2-ylpropan-2-ol?
The InChIKey is UVAYZIZWBVURPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c8-5-6(11)4-7-9-2-1-3-10-7/h1-3,6,11H,4-5,8H2.
What are the key properties of 1-amino-3-pyrimidin-2-ylpropan-2-ol?
1-amino-3-pyrimidin-2-ylpropan-2-ol has a molecular weight of 153.19 g/mol, XLogP of -0.66, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-pyrimidin-2-ylpropan-2-ol is sourced from PubChem (CID 83442577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).