N-hydroxy-2-oxo-N'-propan-2-ylethanimidamide

C5H10N2O2 — CID 175150616

IUPACN-hydroxy-2-oxo-N'-propan-2-ylethanimidamide
SMILESCC(C)/N=C(\C=O)NO
InChIInChI=1S/C5H10N2O2/c1-4(2)6-5(3-8)7-9/h3-4,9H,1-2H3,(H,6,7)
InChIKeyOSRFMINUOFECMU-UHFFFAOYSA-N
MW130.15 g/mol
LogP-0.03
Rot. Bonds2

About N-hydroxy-2-oxo-N'-propan-2-ylethanimidamide

N-hydroxy-2-oxo-N'-propan-2-ylethanimidamide (PubChem CID 175150616) has the molecular formula C5H10N2O2 and a molecular weight of 130.15 g/mol. Its IUPAC name is N-hydroxy-2-oxo-N'-propan-2-ylethanimidamide.

Molecular Properties

Compound NameN-hydroxy-2-oxo-N'-propan-2-ylethanimidamide
PubChem CID175150616
Molecular FormulaC5H10N2O2
Molecular Weight130.15 g/mol
Exact Mass130.07
IUPAC NameN-hydroxy-2-oxo-N'-propan-2-ylethanimidamide
SMILESCC(C)/N=C(\C=O)NO
InChIInChI=1S/C5H10N2O2/c1-4(2)6-5(3-8)7-9/h3-4,9H,1-2H3,(H,6,7)
InChIKeyOSRFMINUOFECMU-UHFFFAOYSA-N
XLogP-0.03
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.15
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

cis-(1S,2S)-N-(C-ethenyl-N-propan-2-ylcarbonimidoyl)-2-fluorocyclopropane-1-carboxamide
CID 167023175
[1-(hydroxyamino)-1-oxopropan-2-yl]azanium
CID 78443389
N,N'-diamino-2-oxoethanimidamide
CID 145012716
1,2,3-tri(propan-2-yl)guanidine
CID 547015
N-ethenyl-N'-methyl-2-oxoethanimidamide
CID 142130799
(Z)-2,3-dimethoxybut-2-enedial
CID 89174688
methyl (E)-2-(C-methyl-N-propan-2-ylcarbonimidoyl)but-2-enoate
CID 123923233
N,N'-di(propan-2-yl)ethanimidamide
CID 11205611
N,N'-diethyl-2-oxoethanimidamide
CID 123980775
N'-methyl-2-oxo-N-[(Z)-prop-1-enyl]ethanimidamide
CID 126606016
N-amino-3,5-dibromo-N'-propan-2-ylbenzenecarboximidamide
CID 107974585
[C-[2-(2-chlorophenyl)ethenyl]-N-propan-2-ylcarbonimidoyl]urea
CID 54555395

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-oxo-N'-propan-2-ylethanimidamide?
The IUPAC name of N-hydroxy-2-oxo-N'-propan-2-ylethanimidamide (CID 175150616) is N-hydroxy-2-oxo-N'-propan-2-ylethanimidamide.
What is the SMILES notation for N-hydroxy-2-oxo-N'-propan-2-ylethanimidamide?
The canonical SMILES for N-hydroxy-2-oxo-N'-propan-2-ylethanimidamide is CC(C)/N=C(\C=O)NO.
What is the InChIKey of N-hydroxy-2-oxo-N'-propan-2-ylethanimidamide?
The InChIKey is OSRFMINUOFECMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O2/c1-4(2)6-5(3-8)7-9/h3-4,9H,1-2H3,(H,6,7).
What are the key properties of N-hydroxy-2-oxo-N'-propan-2-ylethanimidamide?
N-hydroxy-2-oxo-N'-propan-2-ylethanimidamide has a molecular weight of 130.15 g/mol, XLogP of -0.03, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-oxo-N'-propan-2-ylethanimidamide is sourced from PubChem (CID 175150616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).