(6R)-6-fluoro-3-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazole

C9H13FN2 — CID 176599320

IUPAC(6R)-6-fluoro-3-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazole
SMILESCC(C)c1ncc2n1C[C@H](F)C2
InChIInChI=1S/C9H13FN2/c1-6(2)9-11-4-8-3-7(10)5-12(8)9/h4,6-7H,3,5H2,1-2H3/t7-/m1/s1
InChIKeyZDGNJDRGVMEWDX-SSDOTTSWSA-N
MW168.21 g/mol
LogP1.90
Rot. Bonds1

About (6R)-6-fluoro-3-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazole

(6R)-6-fluoro-3-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazole (PubChem CID 176599320) has the molecular formula C9H13FN2 and a molecular weight of 168.21 g/mol. Its IUPAC name is (6R)-6-fluoro-3-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazole.

Molecular Properties

Compound Name(6R)-6-fluoro-3-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazole
PubChem CID176599320
Molecular FormulaC9H13FN2
Molecular Weight168.21 g/mol
Exact Mass168.11
IUPAC Name(6R)-6-fluoro-3-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazole
SMILESCC(C)c1ncc2n1C[C@H](F)C2
InChIInChI=1S/C9H13FN2/c1-6(2)9-11-4-8-3-7(10)5-12(8)9/h4,6-7H,3,5H2,1-2H3/t7-/m1/s1
InChIKeyZDGNJDRGVMEWDX-SSDOTTSWSA-N
XLogP1.90
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.21
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (6R)-6-fluoro-3-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazole?
The IUPAC name of (6R)-6-fluoro-3-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazole (CID 176599320) is (6R)-6-fluoro-3-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazole.
What is the SMILES notation for (6R)-6-fluoro-3-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazole?
The canonical SMILES for (6R)-6-fluoro-3-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazole is CC(C)c1ncc2n1C[C@H](F)C2.
What is the InChIKey of (6R)-6-fluoro-3-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazole?
The InChIKey is ZDGNJDRGVMEWDX-SSDOTTSWSA-N. The full InChI is InChI=1S/C9H13FN2/c1-6(2)9-11-4-8-3-7(10)5-12(8)9/h4,6-7H,3,5H2,1-2H3/t7-/m1/s1.
What are the key properties of (6R)-6-fluoro-3-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazole?
(6R)-6-fluoro-3-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazole has a molecular weight of 168.21 g/mol, XLogP of 1.90, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-6-fluoro-3-propan-2-yl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazole is sourced from PubChem (CID 176599320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).