2-[4-[(2-methoxy-5-methylphenyl)methoxy]phenyl]ethanimidamide

C17H20N2O2 — CID 62160967

IUPAC2-[4-[(2-methoxy-5-methylphenyl)methoxy]phenyl]ethanimidamide
SMILES[H]/N=C(\N)Cc1ccc(OCc2cc(C)ccc2OC)cc1
InChIInChI=1S/C17H20N2O2/c1-12-3-8-16(20-2)14(9-12)11-21-15-6-4-13(5-7-15)10-17(18)19/h3-9H,10-11H2,1-2H3,(H3,18,19)
InChIKeyMXJORVKCDXBSRM-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.06
Rot. Bonds6

About 2-[4-[(2-methoxy-5-methylphenyl)methoxy]phenyl]ethanimidamide

2-[4-[(2-methoxy-5-methylphenyl)methoxy]phenyl]ethanimidamide (PubChem CID 62160967) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-[4-[(2-methoxy-5-methylphenyl)methoxy]phenyl]ethanimidamide.

Molecular Properties

Compound Name2-[4-[(2-methoxy-5-methylphenyl)methoxy]phenyl]ethanimidamide
PubChem CID62160967
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name2-[4-[(2-methoxy-5-methylphenyl)methoxy]phenyl]ethanimidamide
SMILES[H]/N=C(\N)Cc1ccc(OCc2cc(C)ccc2OC)cc1
InChIInChI=1S/C17H20N2O2/c1-12-3-8-16(20-2)14(9-12)11-21-15-6-4-13(5-7-15)10-17(18)19/h3-9H,10-11H2,1-2H3,(H3,18,19)
InChIKeyMXJORVKCDXBSRM-UHFFFAOYSA-N
XLogP3.06
TPSA68.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-[4-[(3-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanimidamide
CID 43332381
1-[4-[(2-methoxy-5-methylphenyl)methoxy]phenyl]ethanone
CID 60661065
3-fluoro-4-[(2-methoxy-5-methylphenyl)methoxy]benzenecarboximidamide
CID 107666516
1-[4-[(2-methoxy-5-methylphenyl)methoxy]phenyl]ethanamine
CID 62156324
4-[(2,5-dimethylphenyl)methoxy]benzenecarboximidamide
CID 61481990
(1S)-1-[4-[(2-methoxy-5-methylphenyl)methoxy]phenyl]propan-1-ol
CID 78934350
2-[4-[(2-bromophenyl)methoxy]phenyl]ethanimidamide
CID 24709746
3-[(2-methoxy-5-methylphenyl)methoxy]phenol
CID 62159960
methyl 2-amino-3-[4-methoxy-3-[(4-methylphenoxy)methyl]phenyl]propanoate
CID 170883906
2-[4-(thiophen-3-ylmethoxy)phenyl]ethanimidamide
CID 43646216
3-[(2-methoxy-5-methylphenyl)methoxy]aniline
CID 61034710
4-[[3-[(4-carbamimidoyl-2-methoxyphenyl)methoxy]-5-methylphenoxy]methyl]-3-methoxybenzenecarboximidamide
CID 157208014

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(2-methoxy-5-methylphenyl)methoxy]phenyl]ethanimidamide?
The IUPAC name of 2-[4-[(2-methoxy-5-methylphenyl)methoxy]phenyl]ethanimidamide (CID 62160967) is 2-[4-[(2-methoxy-5-methylphenyl)methoxy]phenyl]ethanimidamide.
What is the SMILES notation for 2-[4-[(2-methoxy-5-methylphenyl)methoxy]phenyl]ethanimidamide?
The canonical SMILES for 2-[4-[(2-methoxy-5-methylphenyl)methoxy]phenyl]ethanimidamide is [H]/N=C(\N)Cc1ccc(OCc2cc(C)ccc2OC)cc1.
What is the InChIKey of 2-[4-[(2-methoxy-5-methylphenyl)methoxy]phenyl]ethanimidamide?
The InChIKey is MXJORVKCDXBSRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-12-3-8-16(20-2)14(9-12)11-21-15-6-4-13(5-7-15)10-17(18)19/h3-9H,10-11H2,1-2H3,(H3,18,19).
What are the key properties of 2-[4-[(2-methoxy-5-methylphenyl)methoxy]phenyl]ethanimidamide?
2-[4-[(2-methoxy-5-methylphenyl)methoxy]phenyl]ethanimidamide has a molecular weight of 284.36 g/mol, XLogP of 3.06, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(2-methoxy-5-methylphenyl)methoxy]phenyl]ethanimidamide is sourced from PubChem (CID 62160967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).