2-aminoethanol;1H-pyrimidin-2-one

C6H11N3O2 — CID 175902876

IUPAC2-aminoethanol;1H-pyrimidin-2-one
SMILESNCCO.O=c1nccc[nH]1
InChIInChI=1S/C4H4N2O.C2H7NO/c7-4-5-2-1-3-6-4;3-1-2-4/h1-3H,(H,5,6,7);4H,1-3H2
InChIKeyVRKCFMAYKWIRGH-UHFFFAOYSA-N
MW157.17 g/mol
LogP-1.29
Rot. Bonds1

About 2-aminoethanol;1H-pyrimidin-2-one

2-aminoethanol;1H-pyrimidin-2-one (PubChem CID 175902876) has the molecular formula C6H11N3O2 and a molecular weight of 157.17 g/mol. Its IUPAC name is 2-aminoethanol;1H-pyrimidin-2-one.

Molecular Properties

Compound Name2-aminoethanol;1H-pyrimidin-2-one
PubChem CID175902876
Molecular FormulaC6H11N3O2
Molecular Weight157.17 g/mol
Exact Mass157.09
IUPAC Name2-aminoethanol;1H-pyrimidin-2-one
SMILESNCCO.O=c1nccc[nH]1
InChIInChI=1S/C4H4N2O.C2H7NO/c7-4-5-2-1-3-6-4;3-1-2-4/h1-3H,(H,5,6,7);4H,1-3H2
InChIKeyVRKCFMAYKWIRGH-UHFFFAOYSA-N
XLogP-1.29
TPSA92.00 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.17
LogP ≤ 5-1.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-aminoethanol;1H-pyrimidin-2-one?
The IUPAC name of 2-aminoethanol;1H-pyrimidin-2-one (CID 175902876) is 2-aminoethanol;1H-pyrimidin-2-one.
What is the SMILES notation for 2-aminoethanol;1H-pyrimidin-2-one?
The canonical SMILES for 2-aminoethanol;1H-pyrimidin-2-one is NCCO.O=c1nccc[nH]1.
What is the InChIKey of 2-aminoethanol;1H-pyrimidin-2-one?
The InChIKey is VRKCFMAYKWIRGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4N2O.C2H7NO/c7-4-5-2-1-3-6-4;3-1-2-4/h1-3H,(H,5,6,7);4H,1-3H2.
What are the key properties of 2-aminoethanol;1H-pyrimidin-2-one?
2-aminoethanol;1H-pyrimidin-2-one has a molecular weight of 157.17 g/mol, XLogP of -1.29, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoethanol;1H-pyrimidin-2-one is sourced from PubChem (CID 175902876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).