1-(2-methoxyethyl)-N-[(3-methylphenyl)methyl]imidazol-2-amine

C14H19N3O — CID 106563271

IUPAC1-(2-methoxyethyl)-N-[(3-methylphenyl)methyl]imidazol-2-amine
SMILESCOCCn1ccnc1NCc1cccc(C)c1
InChIInChI=1S/C14H19N3O/c1-12-4-3-5-13(10-12)11-16-14-15-6-7-17(14)8-9-18-2/h3-7,10H,8-9,11H2,1-2H3,(H,15,16)
InChIKeyKESYWWUQJHECGI-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.45
Rot. Bonds6

About 1-(2-methoxyethyl)-N-[(3-methylphenyl)methyl]imidazol-2-amine

1-(2-methoxyethyl)-N-[(3-methylphenyl)methyl]imidazol-2-amine (PubChem CID 106563271) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-N-[(3-methylphenyl)methyl]imidazol-2-amine.

Molecular Properties

Compound Name1-(2-methoxyethyl)-N-[(3-methylphenyl)methyl]imidazol-2-amine
PubChem CID106563271
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name1-(2-methoxyethyl)-N-[(3-methylphenyl)methyl]imidazol-2-amine
SMILESCOCCn1ccnc1NCc1cccc(C)c1
InChIInChI=1S/C14H19N3O/c1-12-4-3-5-13(10-12)11-16-14-15-6-7-17(14)8-9-18-2/h3-7,10H,8-9,11H2,1-2H3,(H,15,16)
InChIKeyKESYWWUQJHECGI-UHFFFAOYSA-N
XLogP2.45
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-methoxypropyl)-1-[(3-methylphenyl)methyl]imidazol-2-amine
CID 106563262
1-(3-methoxypropyl)-N-[(4-methylphenyl)methyl]imidazol-2-amine
CID 106559873
1-(2-methoxyethyl)-N-[[4-(trifluoromethyl)phenyl]methyl]imidazol-2-amine
CID 106570701
1-(2-methoxyethyl)-N-(1H-pyrazol-4-ylmethyl)imidazol-2-amine
CID 106568802
1-(2-methoxyethyl)-N-[3-(methoxymethyl)phenyl]imidazol-2-amine
CID 106567138
N-ethyl-1-[(3-methylphenyl)methyl]imidazol-2-amine
CID 106563268
N-[(3-chlorophenyl)methyl]-1-propylimidazol-2-amine
CID 106570097
1-butyl-N-[2-(3-methylphenyl)ethyl]imidazol-2-amine
CID 106569430
1-[2-(3-methylphenoxy)ethyl]-N-(2-methylpropyl)imidazol-2-amine
CID 106563808
N-(2-bromo-5-methylphenyl)-1-(2-methoxyethyl)imidazol-2-amine
CID 106578947
1-(2-methoxyethyl)-N-(2,4,6-trimethylphenyl)imidazol-2-amine
CID 106555369
1-(2-methoxyethyl)-N-[2-(4-methoxyphenyl)ethyl]imidazol-2-amine
CID 106556779

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-N-[(3-methylphenyl)methyl]imidazol-2-amine?
The IUPAC name of 1-(2-methoxyethyl)-N-[(3-methylphenyl)methyl]imidazol-2-amine (CID 106563271) is 1-(2-methoxyethyl)-N-[(3-methylphenyl)methyl]imidazol-2-amine.
What is the SMILES notation for 1-(2-methoxyethyl)-N-[(3-methylphenyl)methyl]imidazol-2-amine?
The canonical SMILES for 1-(2-methoxyethyl)-N-[(3-methylphenyl)methyl]imidazol-2-amine is COCCn1ccnc1NCc1cccc(C)c1.
What is the InChIKey of 1-(2-methoxyethyl)-N-[(3-methylphenyl)methyl]imidazol-2-amine?
The InChIKey is KESYWWUQJHECGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-12-4-3-5-13(10-12)11-16-14-15-6-7-17(14)8-9-18-2/h3-7,10H,8-9,11H2,1-2H3,(H,15,16).
What are the key properties of 1-(2-methoxyethyl)-N-[(3-methylphenyl)methyl]imidazol-2-amine?
1-(2-methoxyethyl)-N-[(3-methylphenyl)methyl]imidazol-2-amine has a molecular weight of 245.33 g/mol, XLogP of 2.45, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-N-[(3-methylphenyl)methyl]imidazol-2-amine is sourced from PubChem (CID 106563271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).