2-amino-3-hydroxypropanoic acid;azane;nitric acid

C3H11N3O6 — CID 173259395

IUPAC2-amino-3-hydroxypropanoic acid;azane;nitric acid
SMILESN.NC(CO)C(=O)O.O=[N+]([O-])O
InChIInChI=1S/C3H7NO3.HNO3.H3N/c4-2(1-5)3(6)7;2-1(3)4;/h2,5H,1,4H2,(H,6,7);(H,2,3,4);1H3
InChIKeyKWHKPUBOJFOAMQ-UHFFFAOYSA-N
MW185.14 g/mol
LogP-1.80
Rot. Bonds2

About 2-amino-3-hydroxypropanoic acid;azane;nitric acid

2-amino-3-hydroxypropanoic acid;azane;nitric acid (PubChem CID 173259395) has the molecular formula C3H11N3O6 and a molecular weight of 185.14 g/mol. Its IUPAC name is 2-amino-3-hydroxypropanoic acid;azane;nitric acid.

Molecular Properties

Compound Name2-amino-3-hydroxypropanoic acid;azane;nitric acid
PubChem CID173259395
Molecular FormulaC3H11N3O6
Molecular Weight185.14 g/mol
Exact Mass185.06
IUPAC Name2-amino-3-hydroxypropanoic acid;azane;nitric acid
SMILESN.NC(CO)C(=O)O.O=[N+]([O-])O
InChIInChI=1S/C3H7NO3.HNO3.H3N/c4-2(1-5)3(6)7;2-1(3)4;/h2,5H,1,4H2,(H,6,7);(H,2,3,4);1H3
InChIKeyKWHKPUBOJFOAMQ-UHFFFAOYSA-N
XLogP-1.80
TPSA181.92 Ų
H-Bond Donors5
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.14
LogP ≤ 5-1.80
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2S)-2-amino-3-hydroxypropanoic acid;nitric acid
CID 172852587
(2S)-2-amino-3-hydroxy(1,2,3-13C3)propanoic acid
CID 71309922
CID 157089134
CID 157089134
2-amino-3-hydroxypropanoic acid;oxalic acid
CID 174377676
2-amino-3-hydroxypropanoic acid;urea
CID 90283765
trisodium;tris((2S)-2-amino-3-hydroxypropanoic acid);borate
CID 173145098
octakis(2-aminoacetic acid);bis((2S)-2-amino-3-hydroxypropanoic acid)
CID 157446719
potassium;2-amino-3-hydroxypropanoic acid;2-methylpropan-2-olate
CID 174969081
(2S)-2,5-diamino-5-oxopentanoic acid;tris(nitric acid)
CID 86628847
(2S)-2-amino-3-hydroxypropanoic acid;(2R)-2-amino-3-sulfanylpropanoic acid
CID 87207256
(2S)-2-amino-3-hydroxypropanoic acid;isocyanic acid
CID 87840009
(2S)-2-aminobutanedioic acid;bis((2S)-2-amino-3-hydroxypropanoic acid)
CID 162130490

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-hydroxypropanoic acid;azane;nitric acid?
The IUPAC name of 2-amino-3-hydroxypropanoic acid;azane;nitric acid (CID 173259395) is 2-amino-3-hydroxypropanoic acid;azane;nitric acid.
What is the SMILES notation for 2-amino-3-hydroxypropanoic acid;azane;nitric acid?
The canonical SMILES for 2-amino-3-hydroxypropanoic acid;azane;nitric acid is N.NC(CO)C(=O)O.O=[N+]([O-])O.
What is the InChIKey of 2-amino-3-hydroxypropanoic acid;azane;nitric acid?
The InChIKey is KWHKPUBOJFOAMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7NO3.HNO3.H3N/c4-2(1-5)3(6)7;2-1(3)4;/h2,5H,1,4H2,(H,6,7);(H,2,3,4);1H3.
What are the key properties of 2-amino-3-hydroxypropanoic acid;azane;nitric acid?
2-amino-3-hydroxypropanoic acid;azane;nitric acid has a molecular weight of 185.14 g/mol, XLogP of -1.80, 2 rotatable bonds, 5 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-hydroxypropanoic acid;azane;nitric acid is sourced from PubChem (CID 173259395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).