2-cyclopropyl-N'-hydroxyethanimidamide

C5H10N2O — CID 14801678

IUPAC2-cyclopropyl-N'-hydroxyethanimidamide
SMILESN/C(CC1CC1)=N\O
InChIInChI=1S/C5H10N2O/c6-5(7-8)3-4-1-2-4/h4,8H,1-3H2,(H2,6,7)
InChIKeyDXMRZDCNKSWOHT-UHFFFAOYSA-N
MW114.15 g/mol
LogP0.53
Rot. Bonds2

About 2-cyclopropyl-N'-hydroxyethanimidamide

2-cyclopropyl-N'-hydroxyethanimidamide (PubChem CID 14801678) has the molecular formula C5H10N2O and a molecular weight of 114.15 g/mol. Its IUPAC name is 2-cyclopropyl-N'-hydroxyethanimidamide.

Molecular Properties

Compound Name2-cyclopropyl-N'-hydroxyethanimidamide
PubChem CID14801678
Molecular FormulaC5H10N2O
Molecular Weight114.15 g/mol
Exact Mass114.08
IUPAC Name2-cyclopropyl-N'-hydroxyethanimidamide
SMILESN/C(CC1CC1)=N\O
InChIInChI=1S/C5H10N2O/c6-5(7-8)3-4-1-2-4/h4,8H,1-3H2,(H2,6,7)
InChIKeyDXMRZDCNKSWOHT-UHFFFAOYSA-N
XLogP0.53
TPSA58.61 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.15
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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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N'-hydroxyethanimidamide?
The IUPAC name of 2-cyclopropyl-N'-hydroxyethanimidamide (CID 14801678) is 2-cyclopropyl-N'-hydroxyethanimidamide.
What is the SMILES notation for 2-cyclopropyl-N'-hydroxyethanimidamide?
The canonical SMILES for 2-cyclopropyl-N'-hydroxyethanimidamide is N/C(CC1CC1)=N\O.
What is the InChIKey of 2-cyclopropyl-N'-hydroxyethanimidamide?
The InChIKey is DXMRZDCNKSWOHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O/c6-5(7-8)3-4-1-2-4/h4,8H,1-3H2,(H2,6,7).
What are the key properties of 2-cyclopropyl-N'-hydroxyethanimidamide?
2-cyclopropyl-N'-hydroxyethanimidamide has a molecular weight of 114.15 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 2-cyclopropyl-N'-hydroxyethanimidamide is sourced from PubChem (CID 14801678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).