2-(fluoromethyl)-6-methyl-1,2-dihydropyridine

C7H10FN — CID 70459541

IUPAC2-(fluoromethyl)-6-methyl-1,2-dihydropyridine
SMILESCC1=CC=CC(CF)N1
InChIInChI=1S/C7H10FN/c1-6-3-2-4-7(5-8)9-6/h2-4,7,9H,5H2,1H3
InChIKeyRLPSCOKOTLRHSU-UHFFFAOYSA-N
MW127.16 g/mol
LogP1.39
Rot. Bonds1

About 2-(fluoromethyl)-6-methyl-1,2-dihydropyridine

2-(fluoromethyl)-6-methyl-1,2-dihydropyridine (PubChem CID 70459541) has the molecular formula C7H10FN and a molecular weight of 127.16 g/mol. Its IUPAC name is 2-(fluoromethyl)-6-methyl-1,2-dihydropyridine.

Molecular Properties

Compound Name2-(fluoromethyl)-6-methyl-1,2-dihydropyridine
PubChem CID70459541
Molecular FormulaC7H10FN
Molecular Weight127.16 g/mol
Exact Mass127.08
IUPAC Name2-(fluoromethyl)-6-methyl-1,2-dihydropyridine
SMILESCC1=CC=CC(CF)N1
InChIInChI=1S/C7H10FN/c1-6-3-2-4-7(5-8)9-6/h2-4,7,9H,5H2,1H3
InChIKeyRLPSCOKOTLRHSU-UHFFFAOYSA-N
XLogP1.39
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.16
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-Trifluoromethyl-1,2-dihydroazine
CID 18539792
2-Fluoropicoline
CID 69611625
Dihydrocollidin
CID 430194
Dihydrolutidin
CID 5245820
Dihydropicoline
CID 5246423
2,6-Bis(trifluoromethyl)-1,2-dihydropyridine
CID 19807243
2-fluoro-2,3-dimethyl-1H-pyridine
CID 22615259
N-ethyl-3-fluorocyclohexa-1,3-dien-1-amine
CID 70333081
4-fluoro-3-N-methylcyclohexa-1,3-diene-1,3-diamine
CID 89191347
(2Z,4E)-3,5-difluoro-6-methyl-N-prop-2-enylhepta-2,4,6-trien-2-amine
CID 89289612
3-fluoro-N-methylcyclohexa-1,5-dien-1-amine
CID 89291172
N-ethyl-4-fluorocyclohexa-1,5-dien-1-amine
CID 89313772

Frequently Asked Questions

What is the IUPAC name of 2-(fluoromethyl)-6-methyl-1,2-dihydropyridine?
The IUPAC name of 2-(fluoromethyl)-6-methyl-1,2-dihydropyridine (CID 70459541) is 2-(fluoromethyl)-6-methyl-1,2-dihydropyridine.
What is the SMILES notation for 2-(fluoromethyl)-6-methyl-1,2-dihydropyridine?
The canonical SMILES for 2-(fluoromethyl)-6-methyl-1,2-dihydropyridine is CC1=CC=CC(CF)N1.
What is the InChIKey of 2-(fluoromethyl)-6-methyl-1,2-dihydropyridine?
The InChIKey is RLPSCOKOTLRHSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10FN/c1-6-3-2-4-7(5-8)9-6/h2-4,7,9H,5H2,1H3.
What are the key properties of 2-(fluoromethyl)-6-methyl-1,2-dihydropyridine?
2-(fluoromethyl)-6-methyl-1,2-dihydropyridine has a molecular weight of 127.16 g/mol, XLogP of 1.39, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethyl)-6-methyl-1,2-dihydropyridine is sourced from PubChem (CID 70459541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).