N-(2-methoxyethyl)-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]imidazol-2-amine

C14H23N5O — CID 106575995

IUPACN-(2-methoxyethyl)-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]imidazol-2-amine
SMILESCOCCNc1nc(C)cn1Cc1c(C)nn(C)c1C
InChIInChI=1S/C14H23N5O/c1-10-8-19(14(16-10)15-6-7-20-5)9-13-11(2)17-18(4)12(13)3/h8H,6-7,9H2,1-5H3,(H,15,16)
InChIKeyQGVYIUKZRVZASE-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.65
Rot. Bonds6

About N-(2-methoxyethyl)-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]imidazol-2-amine

N-(2-methoxyethyl)-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]imidazol-2-amine (PubChem CID 106575995) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is N-(2-methoxyethyl)-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]imidazol-2-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]imidazol-2-amine
PubChem CID106575995
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC NameN-(2-methoxyethyl)-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]imidazol-2-amine
SMILESCOCCNc1nc(C)cn1Cc1c(C)nn(C)c1C
InChIInChI=1S/C14H23N5O/c1-10-8-19(14(16-10)15-6-7-20-5)9-13-11(2)17-18(4)12(13)3/h8H,6-7,9H2,1-5H3,(H,15,16)
InChIKeyQGVYIUKZRVZASE-UHFFFAOYSA-N
XLogP1.65
TPSA56.90 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.65
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-(2-methoxyethyl)-4-methyl-1-[(2-methylphenyl)methyl]imidazol-2-amine
CID 106563145
1-(2-cyclopropylethyl)-N-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106575804
1-(cyclopropylmethyl)-N-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106555207
N-(2-methoxyethyl)-4-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-amine
CID 106582991
N-[2-(2-methoxyethoxy)ethyl]-4-methyl-1-propylimidazol-2-amine
CID 106564440
N-(2-methoxyethyl)-4-methyl-1-(3-pyrrolidin-1-ylpropyl)imidazol-2-amine
CID 106572059
1-[2-(4-chlorophenyl)ethyl]-N-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106568099
1-[(3-ethyl-2-pyridinyl)methyl]-N-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106578970
N-(3-methoxypropyl)-4-methyl-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]imidazol-2-amine
CID 106567823
N-(2-methoxyethyl)-4-methyl-1-(3-methylsulfinylbutyl)imidazol-2-amine
CID 106580263
1-[2-(2-methoxyethoxy)ethyl]-N-(3-methoxypropyl)-4-methylimidazol-2-amine
CID 106564456
1-(2-methoxyethyl)-4-methyl-N-octylimidazol-2-amine
CID 106578866

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]imidazol-2-amine?
The IUPAC name of N-(2-methoxyethyl)-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]imidazol-2-amine (CID 106575995) is N-(2-methoxyethyl)-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]imidazol-2-amine.
What is the SMILES notation for N-(2-methoxyethyl)-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]imidazol-2-amine?
The canonical SMILES for N-(2-methoxyethyl)-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]imidazol-2-amine is COCCNc1nc(C)cn1Cc1c(C)nn(C)c1C.
What is the InChIKey of N-(2-methoxyethyl)-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]imidazol-2-amine?
The InChIKey is QGVYIUKZRVZASE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c1-10-8-19(14(16-10)15-6-7-20-5)9-13-11(2)17-18(4)12(13)3/h8H,6-7,9H2,1-5H3,(H,15,16).
What are the key properties of N-(2-methoxyethyl)-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]imidazol-2-amine?
N-(2-methoxyethyl)-4-methyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]imidazol-2-amine has a molecular weight of 277.37 g/mol, XLogP of 1.65, 6 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-[(1,3,5-trimethylpyrazol-4-yl)methyl]imidazol-2-amine is sourced from PubChem (CID 106575995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).