5-(oxolan-2-yl)-4,5-dihydro-1H-imidazol-2-amine

C7H13N3O — CID 82836700

IUPAC5-(oxolan-2-yl)-4,5-dihydro-1H-imidazol-2-amine
SMILESNC1=NCC(C2CCCO2)N1
InChIInChI=1S/C7H13N3O/c8-7-9-4-5(10-7)6-2-1-3-11-6/h5-6H,1-4H2,(H3,8,9,10)
InChIKeyVMGKEWXJCNKNJP-UHFFFAOYSA-N
MW155.20 g/mol
LogP-0.55
Rot. Bonds1

About 5-(oxolan-2-yl)-4,5-dihydro-1H-imidazol-2-amine

5-(oxolan-2-yl)-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 82836700) has the molecular formula C7H13N3O and a molecular weight of 155.20 g/mol. Its IUPAC name is 5-(oxolan-2-yl)-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound Name5-(oxolan-2-yl)-4,5-dihydro-1H-imidazol-2-amine
PubChem CID82836700
Molecular FormulaC7H13N3O
Molecular Weight155.20 g/mol
Exact Mass155.11
IUPAC Name5-(oxolan-2-yl)-4,5-dihydro-1H-imidazol-2-amine
SMILESNC1=NCC(C2CCCO2)N1
InChIInChI=1S/C7H13N3O/c8-7-9-4-5(10-7)6-2-1-3-11-6/h5-6H,1-4H2,(H3,8,9,10)
InChIKeyVMGKEWXJCNKNJP-UHFFFAOYSA-N
XLogP-0.55
TPSA59.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 5-0.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(oxolan-2-yl)-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of 5-(oxolan-2-yl)-4,5-dihydro-1H-imidazol-2-amine (CID 82836700) is 5-(oxolan-2-yl)-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for 5-(oxolan-2-yl)-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for 5-(oxolan-2-yl)-4,5-dihydro-1H-imidazol-2-amine is NC1=NCC(C2CCCO2)N1.
What is the InChIKey of 5-(oxolan-2-yl)-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is VMGKEWXJCNKNJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O/c8-7-9-4-5(10-7)6-2-1-3-11-6/h5-6H,1-4H2,(H3,8,9,10).
What are the key properties of 5-(oxolan-2-yl)-4,5-dihydro-1H-imidazol-2-amine?
5-(oxolan-2-yl)-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 155.20 g/mol, XLogP of -0.55, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(oxolan-2-yl)-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 82836700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).