N-(3-ethoxypropyl)-1-(3-ethyl-1-methylpyrazol-4-yl)-4-methylimidazol-2-amine

C15H25N5O — CID 107465450

IUPACN-(3-ethoxypropyl)-1-(3-ethyl-1-methylpyrazol-4-yl)-4-methylimidazol-2-amine
SMILESCCOCCCNc1nc(C)cn1-c1cn(C)nc1CC
InChIInChI=1S/C15H25N5O/c1-5-13-14(11-19(4)18-13)20-10-12(3)17-15(20)16-8-7-9-21-6-2/h10-11H,5-9H2,1-4H3,(H,16,17)
InChIKeyLSYVYNHXNRHGIT-UHFFFAOYSA-N
MW291.40 g/mol
LogP2.32
Rot. Bonds8

About N-(3-ethoxypropyl)-1-(3-ethyl-1-methylpyrazol-4-yl)-4-methylimidazol-2-amine

N-(3-ethoxypropyl)-1-(3-ethyl-1-methylpyrazol-4-yl)-4-methylimidazol-2-amine (PubChem CID 107465450) has the molecular formula C15H25N5O and a molecular weight of 291.40 g/mol. Its IUPAC name is N-(3-ethoxypropyl)-1-(3-ethyl-1-methylpyrazol-4-yl)-4-methylimidazol-2-amine.

Molecular Properties

Compound NameN-(3-ethoxypropyl)-1-(3-ethyl-1-methylpyrazol-4-yl)-4-methylimidazol-2-amine
PubChem CID107465450
Molecular FormulaC15H25N5O
Molecular Weight291.40 g/mol
Exact Mass291.21
IUPAC NameN-(3-ethoxypropyl)-1-(3-ethyl-1-methylpyrazol-4-yl)-4-methylimidazol-2-amine
SMILESCCOCCCNc1nc(C)cn1-c1cn(C)nc1CC
InChIInChI=1S/C15H25N5O/c1-5-13-14(11-19(4)18-13)20-10-12(3)17-15(20)16-8-7-9-21-6-2/h10-11H,5-9H2,1-4H3,(H,16,17)
InChIKeyLSYVYNHXNRHGIT-UHFFFAOYSA-N
XLogP2.32
TPSA56.90 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze N-(3-ethoxypropyl)-1-(3-ethyl-1-methylpyrazol-4-yl)-4-methylimidazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2,4-dibromophenyl)-N-(3-ethoxypropyl)-4-methylimidazol-2-amine
CID 106568715
1-cyclopentyl-N-(3-ethoxypropyl)-4-methylimidazol-2-amine
CID 106554998
1-cyclobutyl-N-(3-ethoxypropyl)-4-methylimidazol-2-amine
CID 106571408
N-(3-ethoxypropyl)-4-methyl-1-(3-methylsulfonylpropyl)imidazol-2-amine
CID 106564683
1-(3-cyclopropylpropyl)-N-(3-ethoxypropyl)-4-methylimidazol-2-amine
CID 106582520
1-(cyclopentylmethyl)-N-(3-ethoxypropyl)-4-methylimidazol-2-amine
CID 106561789
N-(3-ethoxypropyl)-4-methyl-1-(1,3-thiazol-2-ylmethyl)imidazol-2-amine
CID 106565661
N-[1-(3-ethoxypropyl)-4-methylimidazol-2-yl]-N'-ethyl-N'-methylethane-1,2-diamine
CID 106570399
N-(3-ethoxypropyl)-4-methyl-1-(1-thiophen-2-ylpropyl)imidazol-2-amine
CID 106564369
1-[(2-bromophenyl)methyl]-N-(3-ethoxypropyl)-4-methylimidazol-2-amine
CID 106566799
N-(3-ethoxypropyl)-4-methyl-1-(2-methylsulfinylpropyl)imidazol-2-amine
CID 106581056
1-(1-cyclohexylethyl)-N-(3-ethoxypropyl)-4-methylimidazol-2-amine
CID 106571259

Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxypropyl)-1-(3-ethyl-1-methylpyrazol-4-yl)-4-methylimidazol-2-amine?
The IUPAC name of N-(3-ethoxypropyl)-1-(3-ethyl-1-methylpyrazol-4-yl)-4-methylimidazol-2-amine (CID 107465450) is N-(3-ethoxypropyl)-1-(3-ethyl-1-methylpyrazol-4-yl)-4-methylimidazol-2-amine.
What is the SMILES notation for N-(3-ethoxypropyl)-1-(3-ethyl-1-methylpyrazol-4-yl)-4-methylimidazol-2-amine?
The canonical SMILES for N-(3-ethoxypropyl)-1-(3-ethyl-1-methylpyrazol-4-yl)-4-methylimidazol-2-amine is CCOCCCNc1nc(C)cn1-c1cn(C)nc1CC.
What is the InChIKey of N-(3-ethoxypropyl)-1-(3-ethyl-1-methylpyrazol-4-yl)-4-methylimidazol-2-amine?
The InChIKey is LSYVYNHXNRHGIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5O/c1-5-13-14(11-19(4)18-13)20-10-12(3)17-15(20)16-8-7-9-21-6-2/h10-11H,5-9H2,1-4H3,(H,16,17).
What are the key properties of N-(3-ethoxypropyl)-1-(3-ethyl-1-methylpyrazol-4-yl)-4-methylimidazol-2-amine?
N-(3-ethoxypropyl)-1-(3-ethyl-1-methylpyrazol-4-yl)-4-methylimidazol-2-amine has a molecular weight of 291.40 g/mol, XLogP of 2.32, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxypropyl)-1-(3-ethyl-1-methylpyrazol-4-yl)-4-methylimidazol-2-amine is sourced from PubChem (CID 107465450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).