1-(cyclopropylmethyl)-8'-methylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine

C14H24N4 — CID 79521583

IUPAC1-(cyclopropylmethyl)-8'-methylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine
SMILESCN1C2CCC1CC1(CN=C(N)N1CC1CC1)C2
InChIInChI=1S/C14H24N4/c1-17-11-4-5-12(17)7-14(6-11)9-16-13(15)18(14)8-10-2-3-10/h10-12H,2-9H2,1H3,(H2,15,16)
InChIKeyWWHMIPOWEMSJEF-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.02
Rot. Bonds2

About 1-(cyclopropylmethyl)-8'-methylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine

1-(cyclopropylmethyl)-8'-methylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine (PubChem CID 79521583) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-8'-methylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-8'-methylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine
PubChem CID79521583
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name1-(cyclopropylmethyl)-8'-methylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine
SMILESCN1C2CCC1CC1(CN=C(N)N1CC1CC1)C2
InChIInChI=1S/C14H24N4/c1-17-11-4-5-12(17)7-14(6-11)9-16-13(15)18(14)8-10-2-3-10/h10-12H,2-9H2,1H3,(H2,15,16)
InChIKeyWWHMIPOWEMSJEF-UHFFFAOYSA-N
XLogP1.02
TPSA44.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-8'-methylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine?
The IUPAC name of 1-(cyclopropylmethyl)-8'-methylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine (CID 79521583) is 1-(cyclopropylmethyl)-8'-methylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine.
What is the SMILES notation for 1-(cyclopropylmethyl)-8'-methylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine?
The canonical SMILES for 1-(cyclopropylmethyl)-8'-methylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine is CN1C2CCC1CC1(CN=C(N)N1CC1CC1)C2.
What is the InChIKey of 1-(cyclopropylmethyl)-8'-methylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine?
The InChIKey is WWHMIPOWEMSJEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-17-11-4-5-12(17)7-14(6-11)9-16-13(15)18(14)8-10-2-3-10/h10-12H,2-9H2,1H3,(H2,15,16).
What are the key properties of 1-(cyclopropylmethyl)-8'-methylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine?
1-(cyclopropylmethyl)-8'-methylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine has a molecular weight of 248.37 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 1-(cyclopropylmethyl)-8'-methylspiro[4H-imidazole-5,3'-8-azabicyclo[3.2.1]octane]-2-amine is sourced from PubChem (CID 79521583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).