1-amino-3-hydroxypropan-2-one

C3H7NO2 — CID 10909488

IUPAC1-amino-3-hydroxypropan-2-one
SMILESNCC(=O)CO
InChIInChI=1S/C3H7NO2/c4-1-3(6)2-5/h5H,1-2,4H2
InChIKeyWXOQUXSBHUDHSO-UHFFFAOYSA-N
MW89.09 g/mol
LogP-1.49
Rot. Bonds2

About 1-amino-3-hydroxypropan-2-one

1-amino-3-hydroxypropan-2-one (PubChem CID 10909488) has the molecular formula C3H7NO2 and a molecular weight of 89.09 g/mol. Its IUPAC name is 1-amino-3-hydroxypropan-2-one.

Molecular Properties

Compound Name1-amino-3-hydroxypropan-2-one
PubChem CID10909488
Molecular FormulaC3H7NO2
Molecular Weight89.09 g/mol
Exact Mass89.05
IUPAC Name1-amino-3-hydroxypropan-2-one
SMILESNCC(=O)CO
InChIInChI=1S/C3H7NO2/c4-1-3(6)2-5/h5H,1-2,4H2
InChIKeyWXOQUXSBHUDHSO-UHFFFAOYSA-N
XLogP-1.49
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50089.09
LogP ≤ 5-1.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-4-hydroxybutan-2-one
CID 13368156
5-amino-4-oxopentanoic acid;2-hydroxyacetic acid
CID 50943305
1-amino-5-hydroxypentan-2-one;molecular hydrogen
CID 158297094
7-amino-1-hydroxyheptan-2-one
CID 58492627
copper;aminomethanol;carbonate
CID 23118320
aminomethanol;dihydrate
CID 173179339
5-(15N)azanyl-4-oxopentanoic acid
CID 11018904
(3-amino-2-oxopropyl)-trihydroxyphosphanium
CID 57252262
5-amino-1-hydroxy-4,4-dimethylpentan-2-one
CID 157309225
1-deuterio-1,3-dihydroxypropan-2-one
CID 175831178
8-amino-4,7-dioxooctanoic acid
CID 161356163
1-amino-4,4-dimethylpentan-2-one
CID 54132585

Frequently Asked Questions

What is the IUPAC name of 1-amino-3-hydroxypropan-2-one?
The IUPAC name of 1-amino-3-hydroxypropan-2-one (CID 10909488) is 1-amino-3-hydroxypropan-2-one.
What is the SMILES notation for 1-amino-3-hydroxypropan-2-one?
The canonical SMILES for 1-amino-3-hydroxypropan-2-one is NCC(=O)CO.
What is the InChIKey of 1-amino-3-hydroxypropan-2-one?
The InChIKey is WXOQUXSBHUDHSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7NO2/c4-1-3(6)2-5/h5H,1-2,4H2.
What are the key properties of 1-amino-3-hydroxypropan-2-one?
1-amino-3-hydroxypropan-2-one has a molecular weight of 89.09 g/mol, XLogP of -1.49, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-hydroxypropan-2-one is sourced from PubChem (CID 10909488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).