2-methoxy-N',3,5-trimethylbenzenecarboximidamide

C11H16N2O — CID 116827784

IUPAC2-methoxy-N',3,5-trimethylbenzenecarboximidamide
SMILESC/N=C(\N)c1cc(C)cc(C)c1OC
InChIInChI=1S/C11H16N2O/c1-7-5-8(2)10(14-4)9(6-7)11(12)13-3/h5-6H,1-4H3,(H2,12,13)
InChIKeyUQBMDVKOPYNBDW-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.65
Rot. Bonds2

About 2-methoxy-N',3,5-trimethylbenzenecarboximidamide

2-methoxy-N',3,5-trimethylbenzenecarboximidamide (PubChem CID 116827784) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-methoxy-N',3,5-trimethylbenzenecarboximidamide.

Molecular Properties

Compound Name2-methoxy-N',3,5-trimethylbenzenecarboximidamide
PubChem CID116827784
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-methoxy-N',3,5-trimethylbenzenecarboximidamide
SMILESC/N=C(\N)c1cc(C)cc(C)c1OC
InChIInChI=1S/C11H16N2O/c1-7-5-8(2)10(14-4)9(6-7)11(12)13-3/h5-6H,1-4H3,(H2,12,13)
InChIKeyUQBMDVKOPYNBDW-UHFFFAOYSA-N
XLogP1.65
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.65
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'}

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Related Compounds

N'-amino-2-methoxy-3,5-dimethylbenzenecarboximidamide
CID 83531039
ethane;2-methoxy-1,3,5-trimethylbenzene
CID 142174927
4-amino-1-(2-methoxy-3,5-dimethylphenyl)butan-1-one
CID 82341665
2-bromo-2-chloro-1-(2-methoxy-3,5-dimethylphenyl)ethanone
CID 116863877
N'-(2-methoxy-3,5-dimethylphenyl)oxamide
CID 115191556
1-(2-methoxy-3,5-dimethylphenyl)-N',N'-dimethylmethanediamine
CID 116909094
2-(2-methoxy-3,5-dimethylphenyl)acetamide
CID 82491159
N'-hydroxy-4-methoxy-3,5-dimethylbenzenecarboximidamide
CID 65470982
N-(3-hydroxypropyl)-2-methoxy-3,5-dimethylbenzamide
CID 96661449
[1-(aminomethyl)cyclopropyl]-(2-methoxy-3,5-dimethylphenyl)methanone
CID 116921250
[(2-methoxy-3,5-dimethylphenyl)methylideneamino]thiourea
CID 50886436
1-(2-methoxy-3,5-dimethylphenyl)-2-methyl-2-(methylamino)propan-1-one
CID 116918725

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N',3,5-trimethylbenzenecarboximidamide?
The IUPAC name of 2-methoxy-N',3,5-trimethylbenzenecarboximidamide (CID 116827784) is 2-methoxy-N',3,5-trimethylbenzenecarboximidamide.
What is the SMILES notation for 2-methoxy-N',3,5-trimethylbenzenecarboximidamide?
The canonical SMILES for 2-methoxy-N',3,5-trimethylbenzenecarboximidamide is C/N=C(\N)c1cc(C)cc(C)c1OC.
What is the InChIKey of 2-methoxy-N',3,5-trimethylbenzenecarboximidamide?
The InChIKey is UQBMDVKOPYNBDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-7-5-8(2)10(14-4)9(6-7)11(12)13-3/h5-6H,1-4H3,(H2,12,13).
What are the key properties of 2-methoxy-N',3,5-trimethylbenzenecarboximidamide?
2-methoxy-N',3,5-trimethylbenzenecarboximidamide has a molecular weight of 192.26 g/mol, XLogP of 1.65, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N',3,5-trimethylbenzenecarboximidamide is sourced from PubChem (CID 116827784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).