2-(4-cyclobutylpiperazin-1-yl)-N'-hydroxyethanimidamide

C10H20N4O — CID 121201830

IUPAC2-(4-cyclobutylpiperazin-1-yl)-N'-hydroxyethanimidamide
SMILESN/C(CN1CCN(C2CCC2)CC1)=N\O
InChIInChI=1S/C10H20N4O/c11-10(12-15)8-13-4-6-14(7-5-13)9-2-1-3-9/h9,15H,1-8H2,(H2,11,12)
InChIKeyTZFOJBJSDUMIBE-UHFFFAOYSA-N
MW212.30 g/mol
LogP-0.10
Rot. Bonds3

About 2-(4-cyclobutylpiperazin-1-yl)-N'-hydroxyethanimidamide

2-(4-cyclobutylpiperazin-1-yl)-N'-hydroxyethanimidamide (PubChem CID 121201830) has the molecular formula C10H20N4O and a molecular weight of 212.30 g/mol. Its IUPAC name is 2-(4-cyclobutylpiperazin-1-yl)-N'-hydroxyethanimidamide.

Molecular Properties

Compound Name2-(4-cyclobutylpiperazin-1-yl)-N'-hydroxyethanimidamide
PubChem CID121201830
Molecular FormulaC10H20N4O
Molecular Weight212.30 g/mol
Exact Mass212.16
IUPAC Name2-(4-cyclobutylpiperazin-1-yl)-N'-hydroxyethanimidamide
SMILESN/C(CN1CCN(C2CCC2)CC1)=N\O
InChIInChI=1S/C10H20N4O/c11-10(12-15)8-13-4-6-14(7-5-13)9-2-1-3-9/h9,15H,1-8H2,(H2,11,12)
InChIKeyTZFOJBJSDUMIBE-UHFFFAOYSA-N
XLogP-0.10
TPSA65.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 5-0.10
H-Bond Donors ≤ 52
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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Related Compounds

2-(4-cyclobutylpiperazin-1-yl)acetamide;hydrochloride
CID 121020770
N'-hydroxy-2-[4-[(3R)-thiolan-3-yl]piperazin-1-yl]ethanimidamide
CID 129491117
2-(4-ethylpiperazin-1-yl)-N'-hydroxyethanimidamide
CID 74312988
N'-hydroxy-4-(4-piperidin-1-ylpiperidin-1-yl)butanimidamide
CID 61216300
2-(4-cyclohexylsulfonylpiperazin-1-yl)-N'-hydroxyethanimidamide
CID 77011980
2-[(3S)-3-fluoropyrrolidin-1-yl]-N'-hydroxyethanimidamide
CID 129494574
2-(4-cyclopentylpiperazin-1-yl)-1-cyclopropylethanone
CID 63914774
N'-hydroxy-2-[4-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperazin-1-yl]ethanimidamide
CID 102898294
N'-hydroxy-2-[(3S)-3-(hydroxymethyl)pyrrolidin-1-yl]ethanimidamide
CID 129393091
2-[4-(2-ethylbutyl)piperazin-1-yl]-N'-hydroxyethanimidamide
CID 82926646
potassium 2-(4-cyclohexylpiperazin-1-yl)acetate
CID 23674348
4-cyclobutylpiperazine-1-carboxamide
CID 53426578

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclobutylpiperazin-1-yl)-N'-hydroxyethanimidamide?
The IUPAC name of 2-(4-cyclobutylpiperazin-1-yl)-N'-hydroxyethanimidamide (CID 121201830) is 2-(4-cyclobutylpiperazin-1-yl)-N'-hydroxyethanimidamide.
What is the SMILES notation for 2-(4-cyclobutylpiperazin-1-yl)-N'-hydroxyethanimidamide?
The canonical SMILES for 2-(4-cyclobutylpiperazin-1-yl)-N'-hydroxyethanimidamide is N/C(CN1CCN(C2CCC2)CC1)=N\O.
What is the InChIKey of 2-(4-cyclobutylpiperazin-1-yl)-N'-hydroxyethanimidamide?
The InChIKey is TZFOJBJSDUMIBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4O/c11-10(12-15)8-13-4-6-14(7-5-13)9-2-1-3-9/h9,15H,1-8H2,(H2,11,12).
What are the key properties of 2-(4-cyclobutylpiperazin-1-yl)-N'-hydroxyethanimidamide?
2-(4-cyclobutylpiperazin-1-yl)-N'-hydroxyethanimidamide has a molecular weight of 212.30 g/mol, XLogP of -0.10, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclobutylpiperazin-1-yl)-N'-hydroxyethanimidamide is sourced from PubChem (CID 121201830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).