8-(difluoromethyl)-9H-pyrrolo[3,2-h]quinoline

C12H8F2N2 — CID 137289635

IUPAC8-(difluoromethyl)-9H-pyrrolo[3,2-h]quinoline
SMILESFC(F)c1ccc2ccc3ccnc3c2[nH]1
InChIInChI=1S/C12H8F2N2/c13-12(14)9-4-3-7-1-2-8-5-6-15-10(8)11(7)16-9/h1-6,12,16H
InChIKeyUHEGBKKACTWFPC-UHFFFAOYSA-N
MW218.21 g/mol
LogP3.65
Rot. Bonds1

About 8-(difluoromethyl)-9H-pyrrolo[3,2-h]quinoline

8-(difluoromethyl)-9H-pyrrolo[3,2-h]quinoline (PubChem CID 137289635) has the molecular formula C12H8F2N2 and a molecular weight of 218.21 g/mol. Its IUPAC name is 8-(difluoromethyl)-9H-pyrrolo[3,2-h]quinoline.

Molecular Properties

Compound Name8-(difluoromethyl)-9H-pyrrolo[3,2-h]quinoline
PubChem CID137289635
Molecular FormulaC12H8F2N2
Molecular Weight218.21 g/mol
Exact Mass218.07
IUPAC Name8-(difluoromethyl)-9H-pyrrolo[3,2-h]quinoline
SMILESFC(F)c1ccc2ccc3ccnc3c2[nH]1
InChIInChI=1S/C12H8F2N2/c13-12(14)9-4-3-7-1-2-8-5-6-15-10(8)11(7)16-9/h1-6,12,16H
InChIKeyUHEGBKKACTWFPC-UHFFFAOYSA-N
XLogP3.65
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.21
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1H-pyrrolo[3,2-h]quinolin-8-amine
CID 928266
3-(Trifluoromethyl)-3,5,6,7-tetrahydro-1,6-naphthyridine
CID 67319476
Trifluoromethylpyrroloquinoline
CID 137225245
2-(fluoromethyl)-1H-pyrrolo[2,3-h]quinoline
CID 141446873
8-(fluoromethyl)-9H-pyrrolo[3,2-h]quinoline
CID 142393205
6,8-bis(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline
CID 154132650
2-(trifluoromethyl)-1H-pyrrolo[2,3-h]quinolin-7-ium
CID 174794836
1-Methylidene-5,9-dihydropyrido[4,3-b]indole
CID 136629763
9-chloro-4-fluoro-7-methyl-6H-pyrrolo[3,2-f]quinoline
CID 136922629
5-methylidene-2-(6-methylidene-1H-pyridin-2-yl)pyridin-1-ium
CID 101241845
6,8-dimethyl-9H-pyrrolo[3,2-h]quinoline
CID 135523687
9H-pyrrolo[3,2-h]quinolin-6-amine
CID 135778893

Frequently Asked Questions

What is the IUPAC name of 8-(difluoromethyl)-9H-pyrrolo[3,2-h]quinoline?
The IUPAC name of 8-(difluoromethyl)-9H-pyrrolo[3,2-h]quinoline (CID 137289635) is 8-(difluoromethyl)-9H-pyrrolo[3,2-h]quinoline.
What is the SMILES notation for 8-(difluoromethyl)-9H-pyrrolo[3,2-h]quinoline?
The canonical SMILES for 8-(difluoromethyl)-9H-pyrrolo[3,2-h]quinoline is FC(F)c1ccc2ccc3ccnc3c2[nH]1.
What is the InChIKey of 8-(difluoromethyl)-9H-pyrrolo[3,2-h]quinoline?
The InChIKey is UHEGBKKACTWFPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8F2N2/c13-12(14)9-4-3-7-1-2-8-5-6-15-10(8)11(7)16-9/h1-6,12,16H.
What are the key properties of 8-(difluoromethyl)-9H-pyrrolo[3,2-h]quinoline?
8-(difluoromethyl)-9H-pyrrolo[3,2-h]quinoline has a molecular weight of 218.21 g/mol, XLogP of 3.65, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(difluoromethyl)-9H-pyrrolo[3,2-h]quinoline is sourced from PubChem (CID 137289635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).