5-ethyl-2-methoxybenzenecarboximidamide

C10H14N2O — CID 82490617

IUPAC5-ethyl-2-methoxybenzenecarboximidamide
SMILES[H]/N=C(\N)c1cc(CC)ccc1OC
InChIInChI=1S/C10H14N2O/c1-3-7-4-5-9(13-2)8(6-7)10(11)12/h4-6H,3H2,1-2H3,(H3,11,12)
InChIKeySGVXCONGSVPNAU-UHFFFAOYSA-N
MW178.23 g/mol
LogP1.54
Rot. Bonds3

About 5-ethyl-2-methoxybenzenecarboximidamide

5-ethyl-2-methoxybenzenecarboximidamide (PubChem CID 82490617) has the molecular formula C10H14N2O and a molecular weight of 178.23 g/mol. Its IUPAC name is 5-ethyl-2-methoxybenzenecarboximidamide.

Molecular Properties

Compound Name5-ethyl-2-methoxybenzenecarboximidamide
PubChem CID82490617
Molecular FormulaC10H14N2O
Molecular Weight178.23 g/mol
Exact Mass178.11
IUPAC Name5-ethyl-2-methoxybenzenecarboximidamide
SMILES[H]/N=C(\N)c1cc(CC)ccc1OC
InChIInChI=1S/C10H14N2O/c1-3-7-4-5-9(13-2)8(6-7)10(11)12/h4-6H,3H2,1-2H3,(H3,11,12)
InChIKeySGVXCONGSVPNAU-UHFFFAOYSA-N
XLogP1.54
TPSA59.10 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 51.54
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-methoxy-5-(propylsulfanylmethyl)benzenecarboximidamide
CID 65339779
5-[(4-chlorophenyl)methoxymethyl]-2-methoxybenzenecarboximidamide
CID 65339965
5-[(4-chloro-2-methylphenoxy)methyl]-2-methoxybenzenecarboximidamide
CID 65340096
5-[(3,4-difluorophenyl)sulfanylmethyl]-2-methoxybenzenecarboximidamide
CID 65339872
2-methoxy-5-[[methyl(2-methylsulfanylethyl)amino]methyl]benzenecarboximidamide
CID 112660240
5-[(4-fluoro-N-methylanilino)methyl]-2-methoxybenzenecarboximidamide
CID 65339992
5-[(2,5-dimethylphenyl)sulfanylmethyl]-2-methoxybenzenecarboximidamide
CID 65340490
5-[[cyclohexyl(methyl)amino]methyl]-2-methoxybenzenecarboximidamide
CID 65338837
5-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]-2-methoxybenzenecarboximidamide
CID 83227573
2-methoxy-5-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]benzenecarboximidamide
CID 65340080
5-[(2,6-dimethylthiomorpholin-4-yl)methyl]-2-methoxybenzenecarboximidamide
CID 65340377
5-[(2-fluorophenyl)sulfanylmethyl]-2-methoxybenzenecarboximidamide
CID 65340206

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-methoxybenzenecarboximidamide?
The IUPAC name of 5-ethyl-2-methoxybenzenecarboximidamide (CID 82490617) is 5-ethyl-2-methoxybenzenecarboximidamide.
What is the SMILES notation for 5-ethyl-2-methoxybenzenecarboximidamide?
The canonical SMILES for 5-ethyl-2-methoxybenzenecarboximidamide is [H]/N=C(\N)c1cc(CC)ccc1OC.
What is the InChIKey of 5-ethyl-2-methoxybenzenecarboximidamide?
The InChIKey is SGVXCONGSVPNAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-3-7-4-5-9(13-2)8(6-7)10(11)12/h4-6H,3H2,1-2H3,(H3,11,12).
What are the key properties of 5-ethyl-2-methoxybenzenecarboximidamide?
5-ethyl-2-methoxybenzenecarboximidamide has a molecular weight of 178.23 g/mol, XLogP of 1.54, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-methoxybenzenecarboximidamide is sourced from PubChem (CID 82490617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).