5-amino-3-(hydroxymethyl)diazinan-4-ol

C5H13N3O2 — CID 71436773

IUPAC5-amino-3-(hydroxymethyl)diazinan-4-ol
SMILESNC1CNNC(CO)C1O
InChIInChI=1S/C5H13N3O2/c6-3-1-7-8-4(2-9)5(3)10/h3-5,7-10H,1-2,6H2
InChIKeyGUQZMTGALDBDEE-UHFFFAOYSA-N
MW147.18 g/mol
LogP-2.86
Rot. Bonds1

About 5-amino-3-(hydroxymethyl)diazinan-4-ol

5-amino-3-(hydroxymethyl)diazinan-4-ol (PubChem CID 71436773) has the molecular formula C5H13N3O2 and a molecular weight of 147.18 g/mol. Its IUPAC name is 5-amino-3-(hydroxymethyl)diazinan-4-ol.

Molecular Properties

Compound Name5-amino-3-(hydroxymethyl)diazinan-4-ol
PubChem CID71436773
Molecular FormulaC5H13N3O2
Molecular Weight147.18 g/mol
Exact Mass147.10
IUPAC Name5-amino-3-(hydroxymethyl)diazinan-4-ol
SMILESNC1CNNC(CO)C1O
InChIInChI=1S/C5H13N3O2/c6-3-1-7-8-4(2-9)5(3)10/h3-5,7-10H,1-2,6H2
InChIKeyGUQZMTGALDBDEE-UHFFFAOYSA-N
XLogP-2.86
TPSA90.54 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.18
LogP ≤ 5-2.86
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

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Related Compounds

(2S,3R,4R,5S,6R)-6-amino-2-(hydroxymethyl)azepane-3,4,5-triol
CID 11469580
(3S,4R,5S)-3-amino-5-(hydroxymethyl)piperidin-4-ol
CID 101020792
(2R,3R,4R)-2-(hydroxymethyl)pyrrolidine-3,4-diol chloride
CID 51371170
(2R,4R)-2-(hydroxymethyl)piperidine-3,4,5-triol;(3S,4S)-2-(hydroxymethyl)piperidine-3,4,5-triol
CID 157357410
(5R)-3-(hydroxymethyl)-6-methyldiazinane-4,5-diol
CID 135040331
(2S,5R)-2,5-bis(hydroxymethyl)pyrrolidine-3,4-diol
CID 59918213
4-amino-2-tetradecylpyrrolidin-3-ol
CID 75576772
2-(hydroxymethyl)piperidine-3,4,5-triol;tungsten
CID 140623793
(1R,2R,3S,5S)-3-amino-2-fluoro-5-(hydroxymethyl)cyclopentan-1-ol
CID 121226647
(1S)-1-[(2R,3R,4S)-4-amino-3-hydroxypyrrolidin-2-yl]ethane-1,2-diol
CID 121227015
(1R,2S,3S,5S)-3-amino-5-(hydroxymethyl)cyclopentane-1,2-diol
CID 171920949
[(3S,4S)-4-aminopyrrolidin-3-yl]methanol
CID 10866309

Frequently Asked Questions

What is the IUPAC name of 5-amino-3-(hydroxymethyl)diazinan-4-ol?
The IUPAC name of 5-amino-3-(hydroxymethyl)diazinan-4-ol (CID 71436773) is 5-amino-3-(hydroxymethyl)diazinan-4-ol.
What is the SMILES notation for 5-amino-3-(hydroxymethyl)diazinan-4-ol?
The canonical SMILES for 5-amino-3-(hydroxymethyl)diazinan-4-ol is NC1CNNC(CO)C1O.
What is the InChIKey of 5-amino-3-(hydroxymethyl)diazinan-4-ol?
The InChIKey is GUQZMTGALDBDEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13N3O2/c6-3-1-7-8-4(2-9)5(3)10/h3-5,7-10H,1-2,6H2.
What are the key properties of 5-amino-3-(hydroxymethyl)diazinan-4-ol?
5-amino-3-(hydroxymethyl)diazinan-4-ol has a molecular weight of 147.18 g/mol, XLogP of -2.86, 1 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-3-(hydroxymethyl)diazinan-4-ol is sourced from PubChem (CID 71436773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).