N'-phenylmethoxybenzenecarboximidamide

C14H14N2O — CID 2754980

IUPACN'-phenylmethoxybenzenecarboximidamide
SMILESNC(=NOCc1ccccc1)c1ccccc1
InChIInChI=1S/C14H14N2O/c15-14(13-9-5-2-6-10-13)16-17-11-12-7-3-1-4-8-12/h1-10H,11H2,(H2,15,16)
InChIKeyJFHLJPZWYARSIE-UHFFFAOYSA-N
MW226.28 g/mol
LogP2.52
Rot. Bonds4

About N'-phenylmethoxybenzenecarboximidamide

N'-phenylmethoxybenzenecarboximidamide (PubChem CID 2754980) has the molecular formula C14H14N2O and a molecular weight of 226.28 g/mol. Its IUPAC name is N'-phenylmethoxybenzenecarboximidamide.

Molecular Properties

Compound NameN'-phenylmethoxybenzenecarboximidamide
PubChem CID2754980
Molecular FormulaC14H14N2O
Molecular Weight226.28 g/mol
Exact Mass226.11
IUPAC NameN'-phenylmethoxybenzenecarboximidamide
SMILESNC(=NOCc1ccccc1)c1ccccc1
InChIInChI=1S/C14H14N2O/c15-14(13-9-5-2-6-10-13)16-17-11-12-7-3-1-4-8-12/h1-10H,11H2,(H2,15,16)
InChIKeyJFHLJPZWYARSIE-UHFFFAOYSA-N
XLogP2.52
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 52.52
H-Bond Donors ≤ 51
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': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-phenylmethoxybenzenecarboximidamide?
The IUPAC name of N'-phenylmethoxybenzenecarboximidamide (CID 2754980) is N'-phenylmethoxybenzenecarboximidamide.
What is the SMILES notation for N'-phenylmethoxybenzenecarboximidamide?
The canonical SMILES for N'-phenylmethoxybenzenecarboximidamide is NC(=NOCc1ccccc1)c1ccccc1.
What is the InChIKey of N'-phenylmethoxybenzenecarboximidamide?
The InChIKey is JFHLJPZWYARSIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O/c15-14(13-9-5-2-6-10-13)16-17-11-12-7-3-1-4-8-12/h1-10H,11H2,(H2,15,16).
What are the key properties of N'-phenylmethoxybenzenecarboximidamide?
N'-phenylmethoxybenzenecarboximidamide has a molecular weight of 226.28 g/mol, XLogP of 2.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-phenylmethoxybenzenecarboximidamide is sourced from PubChem (CID 2754980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).