1-cycloheptyl-N-(3-ethoxypropyl)imidazol-2-amine

C15H27N3O — CID 106561258

IUPAC1-cycloheptyl-N-(3-ethoxypropyl)imidazol-2-amine
SMILESCCOCCCNc1nccn1C1CCCCCC1
InChIInChI=1S/C15H27N3O/c1-2-19-13-7-10-16-15-17-11-12-18(15)14-8-5-3-4-6-9-14/h11-12,14H,2-10,13H2,1H3,(H,16,17)
InChIKeyHAIKIOOLXRLJMZ-UHFFFAOYSA-N
MW265.40 g/mol
LogP3.62
Rot. Bonds7

About 1-cycloheptyl-N-(3-ethoxypropyl)imidazol-2-amine

1-cycloheptyl-N-(3-ethoxypropyl)imidazol-2-amine (PubChem CID 106561258) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is 1-cycloheptyl-N-(3-ethoxypropyl)imidazol-2-amine.

Molecular Properties

Compound Name1-cycloheptyl-N-(3-ethoxypropyl)imidazol-2-amine
PubChem CID106561258
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Name1-cycloheptyl-N-(3-ethoxypropyl)imidazol-2-amine
SMILESCCOCCCNc1nccn1C1CCCCCC1
InChIInChI=1S/C15H27N3O/c1-2-19-13-7-10-16-15-17-11-12-18(15)14-8-5-3-4-6-9-14/h11-12,14H,2-10,13H2,1H3,(H,16,17)
InChIKeyHAIKIOOLXRLJMZ-UHFFFAOYSA-N
XLogP3.62
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(3-ethoxypropyl)-1-(3-methylcyclopentyl)imidazol-2-amine
CID 106581840
N-(3-ethoxypropyl)-1-(1-methylpyrrolidin-3-yl)imidazol-2-amine
CID 106566544
N-butyl-1-cyclobutylimidazol-2-amine
CID 106571396
1-(1-cyclohexylethyl)-N-(3-ethoxypropyl)imidazol-2-amine
CID 106571263
1-(2,2-dimethyloxan-4-yl)-N-(3-ethoxypropyl)imidazol-2-amine
CID 106578750
1-cyclopentyl-N-(3-ethoxypropyl)-4-methylimidazol-2-amine
CID 106554998
1-cyclohexyl-N-(2-cyclopropylethyl)imidazol-2-amine
CID 106575828
1-cyclopentyl-N-(4,4,4-trifluorobutyl)imidazol-2-amine
CID 106579149
1-cyclopropyl-N-propylimidazol-2-amine
CID 106554744
1-cyclopentyl-N-(2-cyclopropylethyl)imidazol-2-amine
CID 106575827
1-cyclopentyl-N-(2-piperidin-1-ylethyl)imidazol-2-amine
CID 106565073
1-cyclobutyl-N-(3-ethoxypropyl)-4-methylimidazol-2-amine
CID 106571408

Frequently Asked Questions

What is the IUPAC name of 1-cycloheptyl-N-(3-ethoxypropyl)imidazol-2-amine?
The IUPAC name of 1-cycloheptyl-N-(3-ethoxypropyl)imidazol-2-amine (CID 106561258) is 1-cycloheptyl-N-(3-ethoxypropyl)imidazol-2-amine.
What is the SMILES notation for 1-cycloheptyl-N-(3-ethoxypropyl)imidazol-2-amine?
The canonical SMILES for 1-cycloheptyl-N-(3-ethoxypropyl)imidazol-2-amine is CCOCCCNc1nccn1C1CCCCCC1.
What is the InChIKey of 1-cycloheptyl-N-(3-ethoxypropyl)imidazol-2-amine?
The InChIKey is HAIKIOOLXRLJMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-2-19-13-7-10-16-15-17-11-12-18(15)14-8-5-3-4-6-9-14/h11-12,14H,2-10,13H2,1H3,(H,16,17).
What are the key properties of 1-cycloheptyl-N-(3-ethoxypropyl)imidazol-2-amine?
1-cycloheptyl-N-(3-ethoxypropyl)imidazol-2-amine has a molecular weight of 265.40 g/mol, XLogP of 3.62, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cycloheptyl-N-(3-ethoxypropyl)imidazol-2-amine is sourced from PubChem (CID 106561258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).