(1-amino-3-hydroxy-1-oxopropan-2-yl)azanium

C3H9N2O2+ — CID 25201551

IUPAC(1-amino-3-hydroxy-1-oxopropan-2-yl)azanium
SMILESNC(=O)C([NH3+])CO
InChIInChI=1S/C3H8N2O2/c4-2(1-6)3(5)7/h2,6H,1,4H2,(H2,5,7)/p+1
InChIKeyMGOGKPMIZGEGOZ-UHFFFAOYSA-O
MW105.12 g/mol
LogP-2.93
Rot. Bonds2

About (1-amino-3-hydroxy-1-oxopropan-2-yl)azanium

(1-amino-3-hydroxy-1-oxopropan-2-yl)azanium (PubChem CID 25201551) has the molecular formula C3H9N2O2+ and a molecular weight of 105.12 g/mol. Its IUPAC name is (1-amino-3-hydroxy-1-oxopropan-2-yl)azanium.

Molecular Properties

Compound Name(1-amino-3-hydroxy-1-oxopropan-2-yl)azanium
PubChem CID25201551
Molecular FormulaC3H9N2O2+
Molecular Weight105.12 g/mol
Exact Mass105.07
IUPAC Name(1-amino-3-hydroxy-1-oxopropan-2-yl)azanium
SMILESNC(=O)C([NH3+])CO
InChIInChI=1S/C3H8N2O2/c4-2(1-6)3(5)7/h2,6H,1,4H2,(H2,5,7)/p+1
InChIKeyMGOGKPMIZGEGOZ-UHFFFAOYSA-O
XLogP-2.93
TPSA90.96 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.12
LogP ≤ 5-2.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

[(1S)-1-carboxy-2-hydroxyethyl]azanium
CID 5460790
[(2R)-1-amino-4-methyl-1-oxopentan-2-yl]azanium
CID 7271814
(2-hydroxy-1-hydroxycarbonylethyl)azanium chloride
CID 165413536
[(2S)-1-amino-6-azaniumyl-1-oxohexan-2-yl]azanium
CID 6991973
(3-hydroxy-1-methoxy-1-oxopropan-2-yl)azanium azide
CID 119095866
2-amino-3-hydroxypropanamide;hydrochloride
CID 3085322
[(4S)-5-amino-4-azaniumyl-5-oxopentyl]-(diaminomethylidene)azanium
CID 6995104
trihydroxy(hydroxymethyl)phosphanium;urea;chloride
CID 118387771
(3-amino-1-carboxy-3-oxopropyl)azanium
CID 5460874
propane-1,2,3-triol;urea;hydrate
CID 174420698
(2S)-3-hydroxy-2-(methylamino)propanamide
CID 10486833
3-hydroxy-2-(methylamino)propanamide
CID 14241499

Frequently Asked Questions

What is the IUPAC name of (1-amino-3-hydroxy-1-oxopropan-2-yl)azanium?
The IUPAC name of (1-amino-3-hydroxy-1-oxopropan-2-yl)azanium (CID 25201551) is (1-amino-3-hydroxy-1-oxopropan-2-yl)azanium.
What is the SMILES notation for (1-amino-3-hydroxy-1-oxopropan-2-yl)azanium?
The canonical SMILES for (1-amino-3-hydroxy-1-oxopropan-2-yl)azanium is NC(=O)C([NH3+])CO.
What is the InChIKey of (1-amino-3-hydroxy-1-oxopropan-2-yl)azanium?
The InChIKey is MGOGKPMIZGEGOZ-UHFFFAOYSA-O. The full InChI is InChI=1S/C3H8N2O2/c4-2(1-6)3(5)7/h2,6H,1,4H2,(H2,5,7)/p+1.
What are the key properties of (1-amino-3-hydroxy-1-oxopropan-2-yl)azanium?
(1-amino-3-hydroxy-1-oxopropan-2-yl)azanium has a molecular weight of 105.12 g/mol, XLogP of -2.93, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-amino-3-hydroxy-1-oxopropan-2-yl)azanium is sourced from PubChem (CID 25201551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).