1'-cyclopropyl-1,1-dimethylspiro[2,3-dihydronaphthalene-4,5'-4H-imidazole]-2'-amine

C17H23N3 — CID 79498654

IUPAC1'-cyclopropyl-1,1-dimethylspiro[2,3-dihydronaphthalene-4,5'-4H-imidazole]-2'-amine
SMILESCC1(C)CCC2(CN=C(N)N2C2CC2)c2ccccc21
InChIInChI=1S/C17H23N3/c1-16(2)9-10-17(14-6-4-3-5-13(14)16)11-19-15(18)20(17)12-7-8-12/h3-6,12H,7-11H2,1-2H3,(H2,18,19)
InChIKeyHYQZMYHTOJBDAS-UHFFFAOYSA-N
MW269.39 g/mol
LogP2.75
Rot. Bonds1

About 1'-cyclopropyl-1,1-dimethylspiro[2,3-dihydronaphthalene-4,5'-4H-imidazole]-2'-amine

1'-cyclopropyl-1,1-dimethylspiro[2,3-dihydronaphthalene-4,5'-4H-imidazole]-2'-amine (PubChem CID 79498654) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is 1'-cyclopropyl-1,1-dimethylspiro[2,3-dihydronaphthalene-4,5'-4H-imidazole]-2'-amine.

Molecular Properties

Compound Name1'-cyclopropyl-1,1-dimethylspiro[2,3-dihydronaphthalene-4,5'-4H-imidazole]-2'-amine
PubChem CID79498654
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC Name1'-cyclopropyl-1,1-dimethylspiro[2,3-dihydronaphthalene-4,5'-4H-imidazole]-2'-amine
SMILESCC1(C)CCC2(CN=C(N)N2C2CC2)c2ccccc21
InChIInChI=1S/C17H23N3/c1-16(2)9-10-17(14-6-4-3-5-13(14)16)11-19-15(18)20(17)12-7-8-12/h3-6,12H,7-11H2,1-2H3,(H2,18,19)
InChIKeyHYQZMYHTOJBDAS-UHFFFAOYSA-N
XLogP2.75
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1'-cyclopropyl-1,1-dimethylspiro[2,3-dihydronaphthalene-4,5'-4H-imidazole]-2'-amine?
The IUPAC name of 1'-cyclopropyl-1,1-dimethylspiro[2,3-dihydronaphthalene-4,5'-4H-imidazole]-2'-amine (CID 79498654) is 1'-cyclopropyl-1,1-dimethylspiro[2,3-dihydronaphthalene-4,5'-4H-imidazole]-2'-amine.
What is the SMILES notation for 1'-cyclopropyl-1,1-dimethylspiro[2,3-dihydronaphthalene-4,5'-4H-imidazole]-2'-amine?
The canonical SMILES for 1'-cyclopropyl-1,1-dimethylspiro[2,3-dihydronaphthalene-4,5'-4H-imidazole]-2'-amine is CC1(C)CCC2(CN=C(N)N2C2CC2)c2ccccc21.
What is the InChIKey of 1'-cyclopropyl-1,1-dimethylspiro[2,3-dihydronaphthalene-4,5'-4H-imidazole]-2'-amine?
The InChIKey is HYQZMYHTOJBDAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-16(2)9-10-17(14-6-4-3-5-13(14)16)11-19-15(18)20(17)12-7-8-12/h3-6,12H,7-11H2,1-2H3,(H2,18,19).
What are the key properties of 1'-cyclopropyl-1,1-dimethylspiro[2,3-dihydronaphthalene-4,5'-4H-imidazole]-2'-amine?
1'-cyclopropyl-1,1-dimethylspiro[2,3-dihydronaphthalene-4,5'-4H-imidazole]-2'-amine has a molecular weight of 269.39 g/mol, XLogP of 2.75, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-cyclopropyl-1,1-dimethylspiro[2,3-dihydronaphthalene-4,5'-4H-imidazole]-2'-amine is sourced from PubChem (CID 79498654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).