N-(2-methoxyethyl)-4-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-amine

C13H21N5O — CID 106582991

IUPACN-(2-methoxyethyl)-4-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-amine
SMILESCOCCNc1nc(C)cn1CCc1ccnn1C
InChIInChI=1S/C13H21N5O/c1-11-10-18(13(16-11)14-7-9-19-3)8-5-12-4-6-15-17(12)2/h4,6,10H,5,7-9H2,1-3H3,(H,14,16)
InChIKeyNFLJBZVJRPUSEA-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.23
Rot. Bonds7

About N-(2-methoxyethyl)-4-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-amine

N-(2-methoxyethyl)-4-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-amine (PubChem CID 106582991) has the molecular formula C13H21N5O and a molecular weight of 263.34 g/mol. Its IUPAC name is N-(2-methoxyethyl)-4-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-4-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-amine
PubChem CID106582991
Molecular FormulaC13H21N5O
Molecular Weight263.34 g/mol
Exact Mass263.17
IUPAC NameN-(2-methoxyethyl)-4-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-amine
SMILESCOCCNc1nc(C)cn1CCc1ccnn1C
InChIInChI=1S/C13H21N5O/c1-11-10-18(13(16-11)14-7-9-19-3)8-5-12-4-6-15-17(12)2/h4,6,10H,5,7-9H2,1-3H3,(H,14,16)
InChIKeyNFLJBZVJRPUSEA-UHFFFAOYSA-N
XLogP1.23
TPSA56.90 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-butyl-4-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-amine
CID 106582984
1-[2-(4-chlorophenyl)ethyl]-N-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106568099
N-cyclopentyl-4-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-amine
CID 106582996
N-(2-methoxyethyl)-4-methyl-1-(3-pyrrolidin-1-ylpropyl)imidazol-2-amine
CID 106572059
N-cyclohexyl-4-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-amine
CID 106583003
1-(2-cyclopropylethyl)-N-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106575804
N-(3-methoxypropyl)-4-methyl-1-[2-(1,3-thiazol-2-yl)ethyl]imidazol-2-amine
CID 106571929
N-ethyl-4-methyl-1-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine
CID 106573703
N-(2-methoxyethyl)-4-methyl-1-(3-methylsulfinylbutyl)imidazol-2-amine
CID 106580263
1-(2-methoxyethyl)-4-methyl-N-octylimidazol-2-amine
CID 106578866
N-[2-(2-methoxyethoxy)ethyl]-4-methyl-1-propylimidazol-2-amine
CID 106564440
1-[2-(2-methoxyethoxy)ethyl]-N-(3-methoxypropyl)-4-methylimidazol-2-amine
CID 106564456

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-4-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-amine?
The IUPAC name of N-(2-methoxyethyl)-4-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-amine (CID 106582991) is N-(2-methoxyethyl)-4-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-amine.
What is the SMILES notation for N-(2-methoxyethyl)-4-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-amine?
The canonical SMILES for N-(2-methoxyethyl)-4-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-amine is COCCNc1nc(C)cn1CCc1ccnn1C.
What is the InChIKey of N-(2-methoxyethyl)-4-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-amine?
The InChIKey is NFLJBZVJRPUSEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O/c1-11-10-18(13(16-11)14-7-9-19-3)8-5-12-4-6-15-17(12)2/h4,6,10H,5,7-9H2,1-3H3,(H,14,16).
What are the key properties of N-(2-methoxyethyl)-4-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-amine?
N-(2-methoxyethyl)-4-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-amine has a molecular weight of 263.34 g/mol, XLogP of 1.23, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-4-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-amine is sourced from PubChem (CID 106582991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).