N'-hydroxynaphthalene-1-carboximidamide

C11H10N2O — CID 54461807

IUPACN'-hydroxynaphthalene-1-carboximidamide
SMILESNC(=NO)c1cccc2ccccc12
InChIInChI=1S/C11H10N2O/c12-11(13-14)10-7-3-5-8-4-1-2-6-9(8)10/h1-7,14H,(H2,12,13)
InChIKeyXCCXRWMQIFDSFC-UHFFFAOYSA-N
MW186.21 g/mol
LogP1.93
Rot. Bonds1

About N'-hydroxynaphthalene-1-carboximidamide

N'-hydroxynaphthalene-1-carboximidamide (PubChem CID 54461807) has the molecular formula C11H10N2O and a molecular weight of 186.21 g/mol. Its IUPAC name is N'-hydroxynaphthalene-1-carboximidamide.

Molecular Properties

Compound NameN'-hydroxynaphthalene-1-carboximidamide
PubChem CID54461807
Molecular FormulaC11H10N2O
Molecular Weight186.21 g/mol
Exact Mass186.08
IUPAC NameN'-hydroxynaphthalene-1-carboximidamide
SMILESNC(=NO)c1cccc2ccccc12
InChIInChI=1S/C11H10N2O/c12-11(13-14)10-7-3-5-8-4-1-2-6-9(8)10/h1-7,14H,(H2,12,13)
InChIKeyXCCXRWMQIFDSFC-UHFFFAOYSA-N
XLogP1.93
TPSA58.61 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 51.93
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 N'-hydroxynaphthalene-1-carboximidamide?
The IUPAC name of N'-hydroxynaphthalene-1-carboximidamide (CID 54461807) is N'-hydroxynaphthalene-1-carboximidamide.
What is the SMILES notation for N'-hydroxynaphthalene-1-carboximidamide?
The canonical SMILES for N'-hydroxynaphthalene-1-carboximidamide is NC(=NO)c1cccc2ccccc12.
What is the InChIKey of N'-hydroxynaphthalene-1-carboximidamide?
The InChIKey is XCCXRWMQIFDSFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O/c12-11(13-14)10-7-3-5-8-4-1-2-6-9(8)10/h1-7,14H,(H2,12,13).
What are the key properties of N'-hydroxynaphthalene-1-carboximidamide?
N'-hydroxynaphthalene-1-carboximidamide has a molecular weight of 186.21 g/mol, XLogP of 1.93, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxynaphthalene-1-carboximidamide is sourced from PubChem (CID 54461807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).