2-[2-(cyclopenten-1-yl)ethyl]-1-ethylguanidine

C10H19N3 — CID 103842916

IUPAC2-[2-(cyclopenten-1-yl)ethyl]-1-ethylguanidine
SMILESCCN/C(N)=N/CCC1=CCCC1
InChIInChI=1S/C10H19N3/c1-2-12-10(11)13-8-7-9-5-3-4-6-9/h5H,2-4,6-8H2,1H3,(H3,11,12,13)
InChIKeyRZQROYONXLSBGV-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.41
Rot. Bonds4

About 2-[2-(cyclopenten-1-yl)ethyl]-1-ethylguanidine

2-[2-(cyclopenten-1-yl)ethyl]-1-ethylguanidine (PubChem CID 103842916) has the molecular formula C10H19N3 and a molecular weight of 181.28 g/mol. Its IUPAC name is 2-[2-(cyclopenten-1-yl)ethyl]-1-ethylguanidine.

Molecular Properties

Compound Name2-[2-(cyclopenten-1-yl)ethyl]-1-ethylguanidine
PubChem CID103842916
Molecular FormulaC10H19N3
Molecular Weight181.28 g/mol
Exact Mass181.16
IUPAC Name2-[2-(cyclopenten-1-yl)ethyl]-1-ethylguanidine
SMILESCCN/C(N)=N/CCC1=CCCC1
InChIInChI=1S/C10H19N3/c1-2-12-10(11)13-8-7-9-5-3-4-6-9/h5H,2-4,6-8H2,1H3,(H3,11,12,13)
InChIKeyRZQROYONXLSBGV-UHFFFAOYSA-N
XLogP1.41
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Nitensidine A
CID 10246147
1,2-Bis(3,7-dimethylocta-2,6-dienyl)guanidine
CID 162820217
2-decyl-1-[(Z)-octadec-9-enyl]guanidine
CID 172460300
1-[2-(Cyclohexen-1-yl)ethyl]-3-ethyl-2-methylguanidine
CID 95908016
3-[2-(Cyclohexen-1-yl)ethyl]-1,1,2-trimethylguanidine
CID 100611868
1-(6-Aminohexyl)-3-(4-methylpent-3-en-1-yl)guanidine
CID 129661450
1-(5-Aminopentyl)-3-(4-methylpent-3-en-1-yl)guanidine
CID 129661483
3-(4-Methylpent-3-en-1-yl)-1-[9-([7-[(4-methylpent-3-en-1-yl)-carbamimidamido]heptyl]amino)nonyl]guanidine
CID 129661500
1-[2-(Cyclopenten-1-yl)ethyl]-2-methyl-3-(3,3,3-trifluoropropyl)guanidine;hydroiodide
CID 109471598
1-[2-(Cyclopenten-1-yl)ethyl]-2-methyl-3-(3,3,3-trifluoropropyl)guanidine
CID 109471599
1-[2-(Cyclopenten-1-yl)ethyl]-3-ethyl-2-(3,3,3-trifluoropropyl)guanidine;hydroiodide
CID 109474726
1-[2-(Cyclopenten-1-yl)ethyl]-3-ethyl-2-(3,3,3-trifluoropropyl)guanidine
CID 109474727

Frequently Asked Questions

What is the IUPAC name of 2-[2-(cyclopenten-1-yl)ethyl]-1-ethylguanidine?
The IUPAC name of 2-[2-(cyclopenten-1-yl)ethyl]-1-ethylguanidine (CID 103842916) is 2-[2-(cyclopenten-1-yl)ethyl]-1-ethylguanidine.
What is the SMILES notation for 2-[2-(cyclopenten-1-yl)ethyl]-1-ethylguanidine?
The canonical SMILES for 2-[2-(cyclopenten-1-yl)ethyl]-1-ethylguanidine is CCN/C(N)=N/CCC1=CCCC1.
What is the InChIKey of 2-[2-(cyclopenten-1-yl)ethyl]-1-ethylguanidine?
The InChIKey is RZQROYONXLSBGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3/c1-2-12-10(11)13-8-7-9-5-3-4-6-9/h5H,2-4,6-8H2,1H3,(H3,11,12,13).
What are the key properties of 2-[2-(cyclopenten-1-yl)ethyl]-1-ethylguanidine?
2-[2-(cyclopenten-1-yl)ethyl]-1-ethylguanidine has a molecular weight of 181.28 g/mol, XLogP of 1.41, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(cyclopenten-1-yl)ethyl]-1-ethylguanidine is sourced from PubChem (CID 103842916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).