N'-hydroxybutanimidamide

C4H10N2O — CID 2794811

IUPACN'-hydroxybutanimidamide
SMILESCCCC(N)=NO
InChIInChI=1S/C4H10N2O/c1-2-3-4(5)6-7/h7H,2-3H2,1H3,(H2,5,6)
InChIKeyOPENCMFJZQABIY-UHFFFAOYSA-N
MW102.14 g/mol
LogP0.53
Rot. Bonds2

About N'-hydroxybutanimidamide

N'-hydroxybutanimidamide (PubChem CID 2794811) has the molecular formula C4H10N2O and a molecular weight of 102.14 g/mol. Its IUPAC name is N'-hydroxybutanimidamide.

Molecular Properties

Compound NameN'-hydroxybutanimidamide
PubChem CID2794811
Molecular FormulaC4H10N2O
Molecular Weight102.14 g/mol
Exact Mass102.08
IUPAC NameN'-hydroxybutanimidamide
SMILESCCCC(N)=NO
InChIInChI=1S/C4H10N2O/c1-2-3-4(5)6-7/h7H,2-3H2,1H3,(H2,5,6)
InChIKeyOPENCMFJZQABIY-UHFFFAOYSA-N
XLogP0.53
TPSA58.61 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.14
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

CID 224979
CID 224979
CID 2794833
CID 2794833
CID 6521662
CID 6521662
CID 9582835
CID 9582835
CID 5351655
CID 5351655
CID 4136427
CID 4136427
CID 9582833
CID 9582833
CID 5712089
CID 5712089
CID 5354578
CID 5354578
CID 4092053
CID 4092053
CID 5458292
CID 5458292
CID 9648955
CID 9648955

Frequently Asked Questions

What is the IUPAC name of N'-hydroxybutanimidamide?
The IUPAC name of N'-hydroxybutanimidamide (CID 2794811) is N'-hydroxybutanimidamide.
What is the SMILES notation for N'-hydroxybutanimidamide?
The canonical SMILES for N'-hydroxybutanimidamide is CCCC(N)=NO.
What is the InChIKey of N'-hydroxybutanimidamide?
The InChIKey is OPENCMFJZQABIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2O/c1-2-3-4(5)6-7/h7H,2-3H2,1H3,(H2,5,6).
What are the key properties of N'-hydroxybutanimidamide?
N'-hydroxybutanimidamide has a molecular weight of 102.14 g/mol, XLogP of 0.53, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxybutanimidamide is sourced from PubChem (CID 2794811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).