N'-hydroxy-1-phenylcyclopropane-1-carboximidamide

C10H12N2O — CID 59395631

IUPACN'-hydroxy-1-phenylcyclopropane-1-carboximidamide
SMILESN/C(=N\O)C1(c2ccccc2)CC1
InChIInChI=1S/C10H12N2O/c11-9(12-13)10(6-7-10)8-4-2-1-3-5-8/h1-5,13H,6-7H2,(H2,11,12)
InChIKeyQSLURBVCIYBHAF-UHFFFAOYSA-N
MW176.22 g/mol
LogP1.46
Rot. Bonds2

About N'-hydroxy-1-phenylcyclopropane-1-carboximidamide

N'-hydroxy-1-phenylcyclopropane-1-carboximidamide (PubChem CID 59395631) has the molecular formula C10H12N2O and a molecular weight of 176.22 g/mol. Its IUPAC name is N'-hydroxy-1-phenylcyclopropane-1-carboximidamide.

Molecular Properties

Compound NameN'-hydroxy-1-phenylcyclopropane-1-carboximidamide
PubChem CID59395631
Molecular FormulaC10H12N2O
Molecular Weight176.22 g/mol
Exact Mass176.09
IUPAC NameN'-hydroxy-1-phenylcyclopropane-1-carboximidamide
SMILESN/C(=N\O)C1(c2ccccc2)CC1
InChIInChI=1S/C10H12N2O/c11-9(12-13)10(6-7-10)8-4-2-1-3-5-8/h1-5,13H,6-7H2,(H2,11,12)
InChIKeyQSLURBVCIYBHAF-UHFFFAOYSA-N
XLogP1.46
TPSA58.61 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 51.46
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

N'-hydroxy-1-phenylcyclopentane-1-carboximidamide
CID 87165177
1-benzyl-N'-hydroxy-4-phenylpiperidine-4-carboximidamide
CID 59869115
N'-ethyl-1-phenylcyclopropane-1-carboximidamide
CID 63181213
1-phenylcyclopropane-1-carboxamide;hydrochloride
CID 57461944
1-(4-cyclobutyloxyphenyl)-N'-hydroxycyclopropane-1-carboximidamide
CID 156538056
N'-cyclopropyl-1-phenylcyclobutane-1-carboximidamide
CID 63181534
1-benzyl-N'-hydroxycyclopropane-1-carboximidamide
CID 170993565
N-methyl-1-phenylcyclopropane-1-carbohydrazide
CID 116846008
1-phenylcyclopentane-1-carboxamide;dihydrochloride
CID 142770378
N-deuterio-1-phenylcyclopropane-1-carboxamide
CID 175986247
N-[2-(N'-hydroxycarbamimidoyl)cyclopentyl]-1-phenylcyclopropane-1-carboxamide
CID 76978536
1-phenylcyclobutane-1-carboximidamide
CID 46941849

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-1-phenylcyclopropane-1-carboximidamide?
The IUPAC name of N'-hydroxy-1-phenylcyclopropane-1-carboximidamide (CID 59395631) is N'-hydroxy-1-phenylcyclopropane-1-carboximidamide.
What is the SMILES notation for N'-hydroxy-1-phenylcyclopropane-1-carboximidamide?
The canonical SMILES for N'-hydroxy-1-phenylcyclopropane-1-carboximidamide is N/C(=N\O)C1(c2ccccc2)CC1.
What is the InChIKey of N'-hydroxy-1-phenylcyclopropane-1-carboximidamide?
The InChIKey is QSLURBVCIYBHAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O/c11-9(12-13)10(6-7-10)8-4-2-1-3-5-8/h1-5,13H,6-7H2,(H2,11,12).
What are the key properties of N'-hydroxy-1-phenylcyclopropane-1-carboximidamide?
N'-hydroxy-1-phenylcyclopropane-1-carboximidamide has a molecular weight of 176.22 g/mol, XLogP of 1.46, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-1-phenylcyclopropane-1-carboximidamide is sourced from PubChem (CID 59395631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).