7,9-difluoro-1-methyl-2H-quinolizine

C10H9F2N — CID 123865940

IUPAC7,9-difluoro-1-methyl-2H-quinolizine
SMILESCC1=C2C(F)=CC(F)=CN2C=CC1
InChIInChI=1S/C10H9F2N/c1-7-3-2-4-13-6-8(11)5-9(12)10(7)13/h2,4-6H,3H2,1H3
InChIKeyMLVYGTDTGCHWJZ-UHFFFAOYSA-N
MW181.18 g/mol
LogP3.16
Rot. Bonds

About 7,9-difluoro-1-methyl-2H-quinolizine

7,9-difluoro-1-methyl-2H-quinolizine (PubChem CID 123865940) has the molecular formula C10H9F2N and a molecular weight of 181.18 g/mol. Its IUPAC name is 7,9-difluoro-1-methyl-2H-quinolizine.

Molecular Properties

Compound Name7,9-difluoro-1-methyl-2H-quinolizine
PubChem CID123865940
Molecular FormulaC10H9F2N
Molecular Weight181.18 g/mol
Exact Mass181.07
IUPAC Name7,9-difluoro-1-methyl-2H-quinolizine
SMILESCC1=C2C(F)=CC(F)=CN2C=CC1
InChIInChI=1S/C10H9F2N/c1-7-3-2-4-13-6-8(11)5-9(12)10(7)13/h2,4-6H,3H2,1H3
InChIKeyMLVYGTDTGCHWJZ-UHFFFAOYSA-N
XLogP3.16
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.18
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(Cyclopenta-2,4-dien-1-ylidene)-1-methyl-1,2-dihydropyridine
CID 13860310
Pyrido[2,1-a][2]benzazepine
CID 18958943
Benzo[a]quinolizine
CID 57056395
1,10-Dimethyl-1,10-phenanthroline
CID 87727374
Pyrido[1,2-b]isoquinoline
CID 129872472
lithium N,N-dimethyl-4-(trifluoromethyl)benzene-5-id-1-amine
CID 57534395
2-Methylidene-1-(2-methylpropyl)-5-(trifluoromethyl)pyridine
CID 67473380
1-(fluoromethyl)-2H-quinolizine
CID 67907299
9-(trifluoromethyl)-4H-quinolizine
CID 88314887
9-(fluoromethyl)-4H-quinolizine
CID 88500987
1-(fluoromethyl)-4H-quinolizine
CID 88500989
1-(Difluoromethyl)-2-methylidene-5-propan-2-ylpyridine
CID 117878111

Frequently Asked Questions

What is the IUPAC name of 7,9-difluoro-1-methyl-2H-quinolizine?
The IUPAC name of 7,9-difluoro-1-methyl-2H-quinolizine (CID 123865940) is 7,9-difluoro-1-methyl-2H-quinolizine.
What is the SMILES notation for 7,9-difluoro-1-methyl-2H-quinolizine?
The canonical SMILES for 7,9-difluoro-1-methyl-2H-quinolizine is CC1=C2C(F)=CC(F)=CN2C=CC1.
What is the InChIKey of 7,9-difluoro-1-methyl-2H-quinolizine?
The InChIKey is MLVYGTDTGCHWJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F2N/c1-7-3-2-4-13-6-8(11)5-9(12)10(7)13/h2,4-6H,3H2,1H3.
What are the key properties of 7,9-difluoro-1-methyl-2H-quinolizine?
7,9-difluoro-1-methyl-2H-quinolizine has a molecular weight of 181.18 g/mol, XLogP of 3.16, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7,9-difluoro-1-methyl-2H-quinolizine is sourced from PubChem (CID 123865940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).