1-(3-ethoxypropyl)-N-[(6-methyl-2-pyridinyl)methyl]imidazol-2-amine

C15H22N4O — CID 106569327

IUPAC1-(3-ethoxypropyl)-N-[(6-methyl-2-pyridinyl)methyl]imidazol-2-amine
SMILESCCOCCCn1ccnc1NCc1cccc(C)n1
InChIInChI=1S/C15H22N4O/c1-3-20-11-5-9-19-10-8-16-15(19)17-12-14-7-4-6-13(2)18-14/h4,6-8,10H,3,5,9,11-12H2,1-2H3,(H,16,17)
InChIKeyPIALSXSJZKCEPF-UHFFFAOYSA-N
MW274.37 g/mol
LogP2.63
Rot. Bonds8

About 1-(3-ethoxypropyl)-N-[(6-methyl-2-pyridinyl)methyl]imidazol-2-amine

1-(3-ethoxypropyl)-N-[(6-methyl-2-pyridinyl)methyl]imidazol-2-amine (PubChem CID 106569327) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is 1-(3-ethoxypropyl)-N-[(6-methyl-2-pyridinyl)methyl]imidazol-2-amine.

Molecular Properties

Compound Name1-(3-ethoxypropyl)-N-[(6-methyl-2-pyridinyl)methyl]imidazol-2-amine
PubChem CID106569327
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC Name1-(3-ethoxypropyl)-N-[(6-methyl-2-pyridinyl)methyl]imidazol-2-amine
SMILESCCOCCCn1ccnc1NCc1cccc(C)n1
InChIInChI=1S/C15H22N4O/c1-3-20-11-5-9-19-10-8-16-15(19)17-12-14-7-4-6-13(2)18-14/h4,6-8,10H,3,5,9,11-12H2,1-2H3,(H,16,17)
InChIKeyPIALSXSJZKCEPF-UHFFFAOYSA-N
XLogP2.63
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-(3-ethoxypropyl)-N-methylimidazol-2-amine
CID 106555069
N-(2-butoxyethyl)-1-(3-ethoxypropyl)imidazol-2-amine
CID 106568332
N-[1-(3-ethoxypropyl)imidazol-2-yl]-2-methylpyridin-3-amine
CID 106575856
N-(2,3-dichlorophenyl)-1-(3-ethoxypropyl)imidazol-2-amine
CID 106560302
3-[(6-methyl-2-pyridinyl)methylamino]-1-propylpyrazin-2-one
CID 62928286
N-(3-methoxypropyl)-1-[(6-methyl-2-pyridinyl)methyl]imidazol-2-amine
CID 106569348
1-(3-ethoxypropyl)-N-(2-methylbutan-2-yl)imidazol-2-amine
CID 106554767
1-butyl-N-(2-ethoxyethyl)imidazol-2-amine
CID 106554086
1-(3-ethoxypropyl)-N-(2-thiophen-2-ylethyl)imidazol-2-amine
CID 106559064
1-(3-ethoxypropyl)-N-(3-ethylpentan-2-yl)imidazol-2-amine
CID 106572232
1-(3-ethoxypropyl)-N-(2-piperidin-1-ylethyl)imidazol-2-amine
CID 106565048
1-(3-ethoxypropyl)-N-(3-methylsulfinylpropyl)imidazol-2-amine
CID 106580528

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethoxypropyl)-N-[(6-methyl-2-pyridinyl)methyl]imidazol-2-amine?
The IUPAC name of 1-(3-ethoxypropyl)-N-[(6-methyl-2-pyridinyl)methyl]imidazol-2-amine (CID 106569327) is 1-(3-ethoxypropyl)-N-[(6-methyl-2-pyridinyl)methyl]imidazol-2-amine.
What is the SMILES notation for 1-(3-ethoxypropyl)-N-[(6-methyl-2-pyridinyl)methyl]imidazol-2-amine?
The canonical SMILES for 1-(3-ethoxypropyl)-N-[(6-methyl-2-pyridinyl)methyl]imidazol-2-amine is CCOCCCn1ccnc1NCc1cccc(C)n1.
What is the InChIKey of 1-(3-ethoxypropyl)-N-[(6-methyl-2-pyridinyl)methyl]imidazol-2-amine?
The InChIKey is PIALSXSJZKCEPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c1-3-20-11-5-9-19-10-8-16-15(19)17-12-14-7-4-6-13(2)18-14/h4,6-8,10H,3,5,9,11-12H2,1-2H3,(H,16,17).
What are the key properties of 1-(3-ethoxypropyl)-N-[(6-methyl-2-pyridinyl)methyl]imidazol-2-amine?
1-(3-ethoxypropyl)-N-[(6-methyl-2-pyridinyl)methyl]imidazol-2-amine has a molecular weight of 274.37 g/mol, XLogP of 2.63, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethoxypropyl)-N-[(6-methyl-2-pyridinyl)methyl]imidazol-2-amine is sourced from PubChem (CID 106569327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).