8'-methyl-1-propylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine

C13H24N4 — CID 79509961

IUPAC8'-methyl-1-propylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine
SMILESCCCN1C(N)=NCC12CC1CCC(C2)N1C
InChIInChI=1S/C13H24N4/c1-3-6-17-12(14)15-9-13(17)7-10-4-5-11(8-13)16(10)2/h10-11H,3-9H2,1-2H3,(H2,14,15)
InChIKeyQVPVBIKNBUESAZ-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.02
Rot. Bonds2

About 8'-methyl-1-propylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine

8'-methyl-1-propylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine (PubChem CID 79509961) has the molecular formula C13H24N4 and a molecular weight of 236.36 g/mol. Its IUPAC name is 8'-methyl-1-propylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine.

Molecular Properties

Compound Name8'-methyl-1-propylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine
PubChem CID79509961
Molecular FormulaC13H24N4
Molecular Weight236.36 g/mol
Exact Mass236.20
IUPAC Name8'-methyl-1-propylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine
SMILESCCCN1C(N)=NCC12CC1CCC(C2)N1C
InChIInChI=1S/C13H24N4/c1-3-6-17-12(14)15-9-13(17)7-10-4-5-11(8-13)16(10)2/h10-11H,3-9H2,1-2H3,(H2,14,15)
InChIKeyQVPVBIKNBUESAZ-UHFFFAOYSA-N
XLogP1.02
TPSA44.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8'-methyl-1-propylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine?
The IUPAC name of 8'-methyl-1-propylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine (CID 79509961) is 8'-methyl-1-propylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine.
What is the SMILES notation for 8'-methyl-1-propylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine?
The canonical SMILES for 8'-methyl-1-propylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine is CCCN1C(N)=NCC12CC1CCC(C2)N1C.
What is the InChIKey of 8'-methyl-1-propylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine?
The InChIKey is QVPVBIKNBUESAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4/c1-3-6-17-12(14)15-9-13(17)7-10-4-5-11(8-13)16(10)2/h10-11H,3-9H2,1-2H3,(H2,14,15).
What are the key properties of 8'-methyl-1-propylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine?
8'-methyl-1-propylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine has a molecular weight of 236.36 g/mol, XLogP of 1.02, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8'-methyl-1-propylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine is sourced from PubChem (CID 79509961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).