5,5-difluoro-7-methyl-6,7-dihydrocyclopenta[c]pyridine

C9H9F2N — CID 167521278

IUPAC5,5-difluoro-7-methyl-6,7-dihydrocyclopenta[c]pyridine
SMILESCC1CC(F)(F)c2ccncc21
InChIInChI=1S/C9H9F2N/c1-6-4-9(10,11)8-2-3-12-5-7(6)8/h2-3,5-6H,4H2,1H3
InChIKeyMOFQTIWNWRSCDZ-UHFFFAOYSA-N
MW169.17 g/mol
LogP2.68
Rot. Bonds

About 5,5-difluoro-7-methyl-6,7-dihydrocyclopenta[c]pyridine

5,5-difluoro-7-methyl-6,7-dihydrocyclopenta[c]pyridine (PubChem CID 167521278) has the molecular formula C9H9F2N and a molecular weight of 169.17 g/mol. Its IUPAC name is 5,5-difluoro-7-methyl-6,7-dihydrocyclopenta[c]pyridine.

Molecular Properties

Compound Name5,5-difluoro-7-methyl-6,7-dihydrocyclopenta[c]pyridine
PubChem CID167521278
Molecular FormulaC9H9F2N
Molecular Weight169.17 g/mol
Exact Mass169.07
IUPAC Name5,5-difluoro-7-methyl-6,7-dihydrocyclopenta[c]pyridine
SMILESCC1CC(F)(F)c2ccncc21
InChIInChI=1S/C9H9F2N/c1-6-4-9(10,11)8-2-3-12-5-7(6)8/h2-3,5-6H,4H2,1H3
InChIKeyMOFQTIWNWRSCDZ-UHFFFAOYSA-N
XLogP2.68
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.17
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

7-methyl-5,6-dihydrocyclopenta[c]pyridine-5,7-diol
CID 85099612
4-chloro-3-(2,2-dimethylcyclopropyl)pyridine
CID 164582075
ethane;(5S)-5-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine
CID 170960546
4-(3-fluoro-4-pyridinyl)-2,6-dimethyloxan-4-ol
CID 104737699
1,4-dimethyl-1,2,3,4-tetrahydro-2,6-naphthyridine
CID 13143618
4-azatricyclo[6.2.1.02,7]undeca-2(7),3,5-triene;ethane
CID 144567672
3,5-dimethyl-1-(4-methyl-3-pyridinyl)cyclohexan-1-amine
CID 66272032
ethane;4-methyl-1,2,3,4-tetrahydro-1,7-naphthyridine
CID 143028453
1-(3-fluoro-4-pyridinyl)-4-methylcyclohex-2-en-1-ol
CID 165491618
5,6-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridine;ethane
CID 143036463
1,1-dimethyl-2,3-dihydropyrrolo[3,4-c]pyridine
CID 68633294
3-(3,3-difluorocyclopentyl)-4-(trifluoromethyl)pyridine
CID 174946323

Frequently Asked Questions

What is the IUPAC name of 5,5-difluoro-7-methyl-6,7-dihydrocyclopenta[c]pyridine?
The IUPAC name of 5,5-difluoro-7-methyl-6,7-dihydrocyclopenta[c]pyridine (CID 167521278) is 5,5-difluoro-7-methyl-6,7-dihydrocyclopenta[c]pyridine.
What is the SMILES notation for 5,5-difluoro-7-methyl-6,7-dihydrocyclopenta[c]pyridine?
The canonical SMILES for 5,5-difluoro-7-methyl-6,7-dihydrocyclopenta[c]pyridine is CC1CC(F)(F)c2ccncc21.
What is the InChIKey of 5,5-difluoro-7-methyl-6,7-dihydrocyclopenta[c]pyridine?
The InChIKey is MOFQTIWNWRSCDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9F2N/c1-6-4-9(10,11)8-2-3-12-5-7(6)8/h2-3,5-6H,4H2,1H3.
What are the key properties of 5,5-difluoro-7-methyl-6,7-dihydrocyclopenta[c]pyridine?
5,5-difluoro-7-methyl-6,7-dihydrocyclopenta[c]pyridine has a molecular weight of 169.17 g/mol, XLogP of 2.68, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-difluoro-7-methyl-6,7-dihydrocyclopenta[c]pyridine is sourced from PubChem (CID 167521278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).