N-[2-(cyclopenten-1-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine

C10H17N3 — CID 103842900

IUPACN-[2-(cyclopenten-1-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine
SMILESC1=C(CCNC2=NCCN2)CCC1
InChIInChI=1S/C10H17N3/c1-2-4-9(3-1)5-6-11-10-12-7-8-13-10/h3H,1-2,4-8H2,(H2,11,12,13)
InChIKeyZQMUVAWSMTYPPW-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.04
Rot. Bonds3

About N-[2-(cyclopenten-1-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine

N-[2-(cyclopenten-1-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 103842900) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is N-[2-(cyclopenten-1-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-[2-(cyclopenten-1-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine
PubChem CID103842900
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC NameN-[2-(cyclopenten-1-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine
SMILESC1=C(CCNC2=NCCN2)CCC1
InChIInChI=1S/C10H17N3/c1-2-4-9(3-1)5-6-11-10-12-7-8-13-10/h3H,1-2,4-8H2,(H2,11,12,13)
InChIKeyZQMUVAWSMTYPPW-UHFFFAOYSA-N
XLogP1.04
TPSA36.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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-[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
N-(4,5-dihydro-1H-imidazol-2-yl)-N'-[(2R)-6-methylhept-5-en-2-yl]butane-1,4-diamine
CID 121451192
N-[(Z)-octadec-9-enyl]-4,5-dihydro-1H-imidazol-2-amine
CID 172346772
N-[2-(cyclohexen-1-yl)ethyl]-5-hexyl-4,5-dihydro-1H-imidazol-2-amine
CID 10946943
N-[2-(cyclohexen-1-yl)ethyl]-4,5-dihydro-1H-imidazol-3-ium-2-amine chloride
CID 11117857
N-[2-(cyclohexen-1-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine
CID 11117858
1-[2-(Cyclohexen-1-yl)ethyl]-2-methylguanidine
CID 62359713

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopenten-1-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of N-[2-(cyclopenten-1-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine (CID 103842900) is N-[2-(cyclopenten-1-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for N-[2-(cyclopenten-1-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for N-[2-(cyclopenten-1-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine is C1=C(CCNC2=NCCN2)CCC1.
What is the InChIKey of N-[2-(cyclopenten-1-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is ZQMUVAWSMTYPPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-2-4-9(3-1)5-6-11-10-12-7-8-13-10/h3H,1-2,4-8H2,(H2,11,12,13).
What are the key properties of N-[2-(cyclopenten-1-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine?
N-[2-(cyclopenten-1-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 179.27 g/mol, XLogP of 1.04, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopenten-1-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 103842900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).