2-(2-ethylphenoxy)benzenecarboximidamide

C15H16N2O — CID 43364301

IUPAC2-(2-ethylphenoxy)benzenecarboximidamide
SMILES[H]/N=C(\N)c1ccccc1Oc1ccccc1CC
InChIInChI=1S/C15H16N2O/c1-2-11-7-3-5-9-13(11)18-14-10-6-4-8-12(14)15(16)17/h3-10H,2H2,1H3,(H3,16,17)
InChIKeyQZKYJKIXNAOLSC-UHFFFAOYSA-N
MW240.31 g/mol
LogP3.33
Rot. Bonds4

About 2-(2-ethylphenoxy)benzenecarboximidamide

2-(2-ethylphenoxy)benzenecarboximidamide (PubChem CID 43364301) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is 2-(2-ethylphenoxy)benzenecarboximidamide.

Molecular Properties

Compound Name2-(2-ethylphenoxy)benzenecarboximidamide
PubChem CID43364301
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC Name2-(2-ethylphenoxy)benzenecarboximidamide
SMILES[H]/N=C(\N)c1ccccc1Oc1ccccc1CC
InChIInChI=1S/C15H16N2O/c1-2-11-7-3-5-9-13(11)18-14-10-6-4-8-12(14)15(16)17/h3-10H,2H2,1H3,(H3,16,17)
InChIKeyQZKYJKIXNAOLSC-UHFFFAOYSA-N
XLogP3.33
TPSA59.10 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 53.33
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'}

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Related Compounds

2-[2-(hydroxymethyl)phenoxy]benzenecarboximidamide
CID 63653288
2-(2-ethylphenoxy)-3-methylbenzenecarboximidamide
CID 107110639
2-(2-methoxyphenoxy)benzenecarboximidamide
CID 28601438
4-(2-ethylphenoxy)-3-fluorobenzenecarboximidamide
CID 43658562
2-(2-bromophenoxy)benzenecarboximidamide
CID 28601496
4-(2-ethylphenoxy)-3,5-difluorobenzenecarboximidamide
CID 81293862
2-(2-propoxyethoxy)benzenecarboximidamide
CID 63684381
2-[(2-ethylphenoxy)methyl]-5-fluorobenzenecarboximidamide
CID 63291072
5-fluoro-2-[2-(2-hydroxyethyl)phenoxy]benzenecarboximidamide
CID 107712610
3-[2-(2-hydroxyethyl)phenoxy]pyridine-4-carboximidamide
CID 107712652
2-(4-chloronaphthalen-1-yl)oxybenzenecarboximidamide
CID 43804671
4-[2-(2-ethylphenoxy)ethoxy]benzenecarboximidamide
CID 61300591

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylphenoxy)benzenecarboximidamide?
The IUPAC name of 2-(2-ethylphenoxy)benzenecarboximidamide (CID 43364301) is 2-(2-ethylphenoxy)benzenecarboximidamide.
What is the SMILES notation for 2-(2-ethylphenoxy)benzenecarboximidamide?
The canonical SMILES for 2-(2-ethylphenoxy)benzenecarboximidamide is [H]/N=C(\N)c1ccccc1Oc1ccccc1CC.
What is the InChIKey of 2-(2-ethylphenoxy)benzenecarboximidamide?
The InChIKey is QZKYJKIXNAOLSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c1-2-11-7-3-5-9-13(11)18-14-10-6-4-8-12(14)15(16)17/h3-10H,2H2,1H3,(H3,16,17).
What are the key properties of 2-(2-ethylphenoxy)benzenecarboximidamide?
2-(2-ethylphenoxy)benzenecarboximidamide has a molecular weight of 240.31 g/mol, XLogP of 3.33, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylphenoxy)benzenecarboximidamide is sourced from PubChem (CID 43364301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).