2-(1-cyclopentylimidazol-4-yl)ethanimidamide

C10H16N4 — CID 83878208

IUPAC2-(1-cyclopentylimidazol-4-yl)ethanimidamide
SMILES[H]/N=C(\N)Cc1cn(C2CCCC2)cn1
InChIInChI=1S/C10H16N4/c11-10(12)5-8-6-14(7-13-8)9-3-1-2-4-9/h6-7,9H,1-5H2,(H3,11,12)
InChIKeyGPGCVWBUSSLOCE-UHFFFAOYSA-N
MW192.27 g/mol
LogP1.48
Rot. Bonds3

About 2-(1-cyclopentylimidazol-4-yl)ethanimidamide

2-(1-cyclopentylimidazol-4-yl)ethanimidamide (PubChem CID 83878208) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is 2-(1-cyclopentylimidazol-4-yl)ethanimidamide.

Molecular Properties

Compound Name2-(1-cyclopentylimidazol-4-yl)ethanimidamide
PubChem CID83878208
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC Name2-(1-cyclopentylimidazol-4-yl)ethanimidamide
SMILES[H]/N=C(\N)Cc1cn(C2CCCC2)cn1
InChIInChI=1S/C10H16N4/c11-10(12)5-8-6-14(7-13-8)9-3-1-2-4-9/h6-7,9H,1-5H2,(H3,11,12)
InChIKeyGPGCVWBUSSLOCE-UHFFFAOYSA-N
XLogP1.48
TPSA67.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopentylimidazol-4-yl)ethanimidamide?
The IUPAC name of 2-(1-cyclopentylimidazol-4-yl)ethanimidamide (CID 83878208) is 2-(1-cyclopentylimidazol-4-yl)ethanimidamide.
What is the SMILES notation for 2-(1-cyclopentylimidazol-4-yl)ethanimidamide?
The canonical SMILES for 2-(1-cyclopentylimidazol-4-yl)ethanimidamide is [H]/N=C(\N)Cc1cn(C2CCCC2)cn1.
What is the InChIKey of 2-(1-cyclopentylimidazol-4-yl)ethanimidamide?
The InChIKey is GPGCVWBUSSLOCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4/c11-10(12)5-8-6-14(7-13-8)9-3-1-2-4-9/h6-7,9H,1-5H2,(H3,11,12).
What are the key properties of 2-(1-cyclopentylimidazol-4-yl)ethanimidamide?
2-(1-cyclopentylimidazol-4-yl)ethanimidamide has a molecular weight of 192.27 g/mol, XLogP of 1.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopentylimidazol-4-yl)ethanimidamide is sourced from PubChem (CID 83878208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).