2,2-diethyl-5-fluoro-1H-pyridine

C9H14FN — CID 138478316

IUPAC2,2-diethyl-5-fluoro-1H-pyridine
SMILESCCC1(CC)C=CC(F)=CN1
InChIInChI=1S/C9H14FN/c1-3-9(4-2)6-5-8(10)7-11-9/h5-7,11H,3-4H2,1-2H3
InChIKeyRUWXQIIAWMIRIJ-UHFFFAOYSA-N
MW155.22 g/mol
LogP2.52
Rot. Bonds2

About 2,2-diethyl-5-fluoro-1H-pyridine

2,2-diethyl-5-fluoro-1H-pyridine (PubChem CID 138478316) has the molecular formula C9H14FN and a molecular weight of 155.22 g/mol. Its IUPAC name is 2,2-diethyl-5-fluoro-1H-pyridine.

Molecular Properties

Compound Name2,2-diethyl-5-fluoro-1H-pyridine
PubChem CID138478316
Molecular FormulaC9H14FN
Molecular Weight155.22 g/mol
Exact Mass155.11
IUPAC Name2,2-diethyl-5-fluoro-1H-pyridine
SMILESCCC1(CC)C=CC(F)=CN1
InChIInChI=1S/C9H14FN/c1-3-9(4-2)6-5-8(10)7-11-9/h5-7,11H,3-4H2,1-2H3
InChIKeyRUWXQIIAWMIRIJ-UHFFFAOYSA-N
XLogP2.52
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.22
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

10-fluoro-1H-benzo[i]quinoline
CID 87634100
5-(difluoromethyl)-N-ethenyl-4-ethylcyclohexa-1,5-dien-1-amine
CID 130321083
(6S)-4-fluoro-N,1,6-trimethylcyclohexa-2,4-dien-1-amine
CID 134365554
2-ethyl-3-(1-fluoroethyl)-5-[(E)-prop-1-enyl]-1,2-dihydropyridine
CID 134448196
2-ethyl-2-(trifluoromethyl)-1H-pyridine
CID 141379825
4-fluoro-1-methyl-N-propylcyclohexa-2,4-dien-1-amine
CID 143108220
5-fluoro-2,2-dimethyl-1H-pyridine
CID 148036096
2-Propan-2-yl-5-(trifluoromethyl)-1,2-dihydropyridine
CID 149231371
2-ethyl-2-fluoro-1H-pyridine
CID 153953950
3a-Ethyl-5-fluoro-1,7a-dihydroindole
CID 163730223
3,3-Diethylisoquinoline
CID 164890311
4-(1,1-difluoroethyl)-N-ethenylcyclohexa-1,5-dien-1-amine
CID 145500043

Frequently Asked Questions

What is the IUPAC name of 2,2-diethyl-5-fluoro-1H-pyridine?
The IUPAC name of 2,2-diethyl-5-fluoro-1H-pyridine (CID 138478316) is 2,2-diethyl-5-fluoro-1H-pyridine.
What is the SMILES notation for 2,2-diethyl-5-fluoro-1H-pyridine?
The canonical SMILES for 2,2-diethyl-5-fluoro-1H-pyridine is CCC1(CC)C=CC(F)=CN1.
What is the InChIKey of 2,2-diethyl-5-fluoro-1H-pyridine?
The InChIKey is RUWXQIIAWMIRIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14FN/c1-3-9(4-2)6-5-8(10)7-11-9/h5-7,11H,3-4H2,1-2H3.
What are the key properties of 2,2-diethyl-5-fluoro-1H-pyridine?
2,2-diethyl-5-fluoro-1H-pyridine has a molecular weight of 155.22 g/mol, XLogP of 2.52, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethyl-5-fluoro-1H-pyridine is sourced from PubChem (CID 138478316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).