N-cyclopentyloxy-1-(1-ethylimidazol-2-yl)methanamine

C11H19N3O — CID 83229115

IUPACN-cyclopentyloxy-1-(1-ethylimidazol-2-yl)methanamine
SMILESCCn1ccnc1CNOC1CCCC1
InChIInChI=1S/C11H19N3O/c1-2-14-8-7-12-11(14)9-13-15-10-5-3-4-6-10/h7-8,10,13H,2-6,9H2,1H3
InChIKeyAMGYSIYWYATYHL-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.87
Rot. Bonds5

About N-cyclopentyloxy-1-(1-ethylimidazol-2-yl)methanamine

N-cyclopentyloxy-1-(1-ethylimidazol-2-yl)methanamine (PubChem CID 83229115) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is N-cyclopentyloxy-1-(1-ethylimidazol-2-yl)methanamine.

Molecular Properties

Compound NameN-cyclopentyloxy-1-(1-ethylimidazol-2-yl)methanamine
PubChem CID83229115
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC NameN-cyclopentyloxy-1-(1-ethylimidazol-2-yl)methanamine
SMILESCCn1ccnc1CNOC1CCCC1
InChIInChI=1S/C11H19N3O/c1-2-14-8-7-12-11(14)9-13-15-10-5-3-4-6-10/h7-8,10,13H,2-6,9H2,1H3
InChIKeyAMGYSIYWYATYHL-UHFFFAOYSA-N
XLogP1.87
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-[[(1-ethylimidazol-2-yl)methylamino]methyl]cyclohexan-1-ol
CID 106126176
N-cyclopentyloxy-1-(2-ethyl-1,2,4-triazol-3-yl)methanamine
CID 83228490
2-cyclohexyl-N-[(1-ethylimidazol-2-yl)methyl]ethanamine
CID 55064443
N-[(1-ethylimidazol-2-yl)methyl]thian-4-amine
CID 115641638
3-[(1-ethylimidazol-2-yl)methyl]-N-methylcycloheptan-1-amine
CID 79762047
3-ethoxy-N-[(1-ethylimidazol-2-yl)methyl]propan-1-amine
CID 46784365
N-[(1-ethylimidazol-2-yl)methyl]-9-methyl-9-azabicyclo[3.3.1]nonan-3-amine
CID 65471784
N-[(1-butylimidazol-2-yl)methyl]cyclohexanamine
CID 46784421
[1-[(1-ethylimidazol-2-yl)methylamino]cyclobutyl]methanol
CID 115733170
N-[(1-ethylimidazol-2-yl)methyl]-2,3-dimethylcyclopentan-1-amine
CID 64910386
N-[(1-ethylimidazol-2-yl)methyl]propan-1-amine
CID 46784352
2-[(1-ethylimidazol-2-yl)methyl]-1,1-dimethylhydrazine
CID 83003999

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyloxy-1-(1-ethylimidazol-2-yl)methanamine?
The IUPAC name of N-cyclopentyloxy-1-(1-ethylimidazol-2-yl)methanamine (CID 83229115) is N-cyclopentyloxy-1-(1-ethylimidazol-2-yl)methanamine.
What is the SMILES notation for N-cyclopentyloxy-1-(1-ethylimidazol-2-yl)methanamine?
The canonical SMILES for N-cyclopentyloxy-1-(1-ethylimidazol-2-yl)methanamine is CCn1ccnc1CNOC1CCCC1.
What is the InChIKey of N-cyclopentyloxy-1-(1-ethylimidazol-2-yl)methanamine?
The InChIKey is AMGYSIYWYATYHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-2-14-8-7-12-11(14)9-13-15-10-5-3-4-6-10/h7-8,10,13H,2-6,9H2,1H3.
What are the key properties of N-cyclopentyloxy-1-(1-ethylimidazol-2-yl)methanamine?
N-cyclopentyloxy-1-(1-ethylimidazol-2-yl)methanamine has a molecular weight of 209.29 g/mol, XLogP of 1.87, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyloxy-1-(1-ethylimidazol-2-yl)methanamine is sourced from PubChem (CID 83229115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).