(4R)-4-spiro[1,3-dihydroindene-2,2'-cyclopropane]-1'-yl-4,5-dihydro-1H-imidazole

C14H16N2 — CID 135507029

IUPAC(4R)-4-spiro[1,3-dihydroindene-2,2'-cyclopropane]-1'-yl-4,5-dihydro-1H-imidazole
SMILESC1=N[C@H](C2CC23Cc2ccccc2C3)CN1
InChIInChI=1S/C14H16N2/c1-2-4-11-6-14(5-10(11)3-1)7-12(14)13-8-15-9-16-13/h1-4,9,12-13H,5-8H2,(H,15,16)/t12?,13-/m0/s1
InChIKeySCHYCBJINGABST-ABLWVSNPSA-N
MW212.30 g/mol
LogP1.79
Rot. Bonds1

About (4R)-4-spiro[1,3-dihydroindene-2,2'-cyclopropane]-1'-yl-4,5-dihydro-1H-imidazole

(4R)-4-spiro[1,3-dihydroindene-2,2'-cyclopropane]-1'-yl-4,5-dihydro-1H-imidazole (PubChem CID 135507029) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is (4R)-4-spiro[1,3-dihydroindene-2,2'-cyclopropane]-1'-yl-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name(4R)-4-spiro[1,3-dihydroindene-2,2'-cyclopropane]-1'-yl-4,5-dihydro-1H-imidazole
PubChem CID135507029
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name(4R)-4-spiro[1,3-dihydroindene-2,2'-cyclopropane]-1'-yl-4,5-dihydro-1H-imidazole
SMILESC1=N[C@H](C2CC23Cc2ccccc2C3)CN1
InChIInChI=1S/C14H16N2/c1-2-4-11-6-14(5-10(11)3-1)7-12(14)13-8-15-9-16-13/h1-4,9,12-13H,5-8H2,(H,15,16)/t12?,13-/m0/s1
InChIKeySCHYCBJINGABST-ABLWVSNPSA-N
XLogP1.79
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4R)-4-spiro[1,3-dihydroindene-2,2'-cyclopropane]-1'-yl-4,5-dihydro-1H-imidazole?
The IUPAC name of (4R)-4-spiro[1,3-dihydroindene-2,2'-cyclopropane]-1'-yl-4,5-dihydro-1H-imidazole (CID 135507029) is (4R)-4-spiro[1,3-dihydroindene-2,2'-cyclopropane]-1'-yl-4,5-dihydro-1H-imidazole.
What is the SMILES notation for (4R)-4-spiro[1,3-dihydroindene-2,2'-cyclopropane]-1'-yl-4,5-dihydro-1H-imidazole?
The canonical SMILES for (4R)-4-spiro[1,3-dihydroindene-2,2'-cyclopropane]-1'-yl-4,5-dihydro-1H-imidazole is C1=N[C@H](C2CC23Cc2ccccc2C3)CN1.
What is the InChIKey of (4R)-4-spiro[1,3-dihydroindene-2,2'-cyclopropane]-1'-yl-4,5-dihydro-1H-imidazole?
The InChIKey is SCHYCBJINGABST-ABLWVSNPSA-N. The full InChI is InChI=1S/C14H16N2/c1-2-4-11-6-14(5-10(11)3-1)7-12(14)13-8-15-9-16-13/h1-4,9,12-13H,5-8H2,(H,15,16)/t12?,13-/m0/s1.
What are the key properties of (4R)-4-spiro[1,3-dihydroindene-2,2'-cyclopropane]-1'-yl-4,5-dihydro-1H-imidazole?
(4R)-4-spiro[1,3-dihydroindene-2,2'-cyclopropane]-1'-yl-4,5-dihydro-1H-imidazole has a molecular weight of 212.30 g/mol, XLogP of 1.79, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-spiro[1,3-dihydroindene-2,2'-cyclopropane]-1'-yl-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 135507029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).