2-[1-[(2,2-dimethylhydrazinyl)methyl]cyclopropyl]-N'-hydroxyethanimidamide

C8H18N4O — CID 83017020

IUPAC2-[1-[(2,2-dimethylhydrazinyl)methyl]cyclopropyl]-N'-hydroxyethanimidamide
SMILESCN(C)NCC1(CC(N)=NO)CC1
InChIInChI=1S/C8H18N4O/c1-12(2)10-6-8(3-4-8)5-7(9)11-13/h10,13H,3-6H2,1-2H3,(H2,9,11)
InChIKeyREDWJOIXJQPPAB-UHFFFAOYSA-N
MW186.26 g/mol
LogP-0.03
Rot. Bonds5

About 2-[1-[(2,2-dimethylhydrazinyl)methyl]cyclopropyl]-N'-hydroxyethanimidamide

2-[1-[(2,2-dimethylhydrazinyl)methyl]cyclopropyl]-N'-hydroxyethanimidamide (PubChem CID 83017020) has the molecular formula C8H18N4O and a molecular weight of 186.26 g/mol. Its IUPAC name is 2-[1-[(2,2-dimethylhydrazinyl)methyl]cyclopropyl]-N'-hydroxyethanimidamide.

Molecular Properties

Compound Name2-[1-[(2,2-dimethylhydrazinyl)methyl]cyclopropyl]-N'-hydroxyethanimidamide
PubChem CID83017020
Molecular FormulaC8H18N4O
Molecular Weight186.26 g/mol
Exact Mass186.15
IUPAC Name2-[1-[(2,2-dimethylhydrazinyl)methyl]cyclopropyl]-N'-hydroxyethanimidamide
SMILESCN(C)NCC1(CC(N)=NO)CC1
InChIInChI=1S/C8H18N4O/c1-12(2)10-6-8(3-4-8)5-7(9)11-13/h10,13H,3-6H2,1-2H3,(H2,9,11)
InChIKeyREDWJOIXJQPPAB-UHFFFAOYSA-N
XLogP-0.03
TPSA73.88 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.26
LogP ≤ 5-0.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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-[1-[(2,2-dimethylhydrazinyl)methyl]cyclopropyl]-N'-hydroxyethanimidamide?
The IUPAC name of 2-[1-[(2,2-dimethylhydrazinyl)methyl]cyclopropyl]-N'-hydroxyethanimidamide (CID 83017020) is 2-[1-[(2,2-dimethylhydrazinyl)methyl]cyclopropyl]-N'-hydroxyethanimidamide.
What is the SMILES notation for 2-[1-[(2,2-dimethylhydrazinyl)methyl]cyclopropyl]-N'-hydroxyethanimidamide?
The canonical SMILES for 2-[1-[(2,2-dimethylhydrazinyl)methyl]cyclopropyl]-N'-hydroxyethanimidamide is CN(C)NCC1(CC(N)=NO)CC1.
What is the InChIKey of 2-[1-[(2,2-dimethylhydrazinyl)methyl]cyclopropyl]-N'-hydroxyethanimidamide?
The InChIKey is REDWJOIXJQPPAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N4O/c1-12(2)10-6-8(3-4-8)5-7(9)11-13/h10,13H,3-6H2,1-2H3,(H2,9,11).
What are the key properties of 2-[1-[(2,2-dimethylhydrazinyl)methyl]cyclopropyl]-N'-hydroxyethanimidamide?
2-[1-[(2,2-dimethylhydrazinyl)methyl]cyclopropyl]-N'-hydroxyethanimidamide has a molecular weight of 186.26 g/mol, XLogP of -0.03, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(2,2-dimethylhydrazinyl)methyl]cyclopropyl]-N'-hydroxyethanimidamide is sourced from PubChem (CID 83017020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).