(hydroxyamino)cyanamide

CH3N3O — CID 151958223

IUPAC(hydroxyamino)cyanamide
SMILESN#CNNO
InChIInChI=1S/CH3N3O/c2-1-3-4-5/h3-5H
InChIKeyTYBYKKYBBXQBQK-UHFFFAOYSA-N
MW73.06 g/mol
LogP-1.05
Rot. Bonds1

About (hydroxyamino)cyanamide

(hydroxyamino)cyanamide (PubChem CID 151958223) has the molecular formula CH3N3O and a molecular weight of 73.06 g/mol. Its IUPAC name is (hydroxyamino)cyanamide.

Molecular Properties

Compound Name(hydroxyamino)cyanamide
PubChem CID151958223
Molecular FormulaCH3N3O
Molecular Weight73.06 g/mol
Exact Mass73.03
IUPAC Name(hydroxyamino)cyanamide
SMILESN#CNNO
InChIInChI=1S/CH3N3O/c2-1-3-4-5/h3-5H
InChIKeyTYBYKKYBBXQBQK-UHFFFAOYSA-N
XLogP-1.05
TPSA68.08 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50073.06
LogP ≤ 5-1.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cyanate_/aminonitrile_/thiocyanate', 'substructure': 'N/A'}, {'alert_name': 'enamine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

hydroxycyanamide
CID 22316477
azonous acid;hydrate
CID 173024545
cyanocyanamide;sulfane
CID 87898901
[(Z)-1,2-dicyano-2-(cyanoamino)ethenyl]cyanamide
CID 132595102
3-(hydroxyamino)oxypropanenitrile
CID 156648374
oxalonitrile;hydrobromide
CID 86604310
cyanic acid
CID 540
carbononitridic bromide
CID 160583865
krypton;oxalonitrile
CID 158797974
bis(oxalonitrile);hydrochloride
CID 88841544
1-aminoethenylcyanamide
CID 131531225
cyanic acid;vanadium
CID 173176163

Frequently Asked Questions

What is the IUPAC name of (hydroxyamino)cyanamide?
The IUPAC name of (hydroxyamino)cyanamide (CID 151958223) is (hydroxyamino)cyanamide.
What is the SMILES notation for (hydroxyamino)cyanamide?
The canonical SMILES for (hydroxyamino)cyanamide is N#CNNO.
What is the InChIKey of (hydroxyamino)cyanamide?
The InChIKey is TYBYKKYBBXQBQK-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3N3O/c2-1-3-4-5/h3-5H.
What are the key properties of (hydroxyamino)cyanamide?
(hydroxyamino)cyanamide has a molecular weight of 73.06 g/mol, XLogP of -1.05, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (hydroxyamino)cyanamide is sourced from PubChem (CID 151958223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).