4-fluoro-1-propan-2-yl-3,6-dihydro-2H-pyridine

C8H14FN — CID 166157383

IUPAC4-fluoro-1-propan-2-yl-3,6-dihydro-2H-pyridine
SMILESCC(C)N1CC=C(F)CC1
InChIInChI=1S/C8H14FN/c1-7(2)10-5-3-8(9)4-6-10/h3,7H,4-6H2,1-2H3
InChIKeyXBZSTDDFWDUJCD-UHFFFAOYSA-N
MW143.21 g/mol
LogP1.95
Rot. Bonds1

About 4-fluoro-1-propan-2-yl-3,6-dihydro-2H-pyridine

4-fluoro-1-propan-2-yl-3,6-dihydro-2H-pyridine (PubChem CID 166157383) has the molecular formula C8H14FN and a molecular weight of 143.21 g/mol. Its IUPAC name is 4-fluoro-1-propan-2-yl-3,6-dihydro-2H-pyridine.

Molecular Properties

Compound Name4-fluoro-1-propan-2-yl-3,6-dihydro-2H-pyridine
PubChem CID166157383
Molecular FormulaC8H14FN
Molecular Weight143.21 g/mol
Exact Mass143.11
IUPAC Name4-fluoro-1-propan-2-yl-3,6-dihydro-2H-pyridine
SMILESCC(C)N1CC=C(F)CC1
InChIInChI=1S/C8H14FN/c1-7(2)10-5-3-8(9)4-6-10/h3,7H,4-6H2,1-2H3
InChIKeyXBZSTDDFWDUJCD-UHFFFAOYSA-N
XLogP1.95
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.21
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,2-Dimethyl-1,2,3,6-tetrahydropyridine
CID 565854
1-Propyl-1,2,3,6-tetrahydropyridine
CID 357826
(r,s)-1,6-Dimethyl-1,2,3,6-tetrahydro-pyridine
CID 641109
Pyridine, 1,2,5,6-tetrahydro-1,2,4-trimethyl-
CID 23423765
Pyridine, 1,2,5,6-tetrahydro-1,2-dimethyl-
CID 565859
1,3,6-trimethyl-3,6-dihydro-2H-pyridine
CID 57699449
1-fluoro-N-methyl-N-propylcyclohexa-2,4-dien-1-amine
CID 22637871
4-fluoro-1-methyl-3,6-dihydro-2H-pyridine
CID 58799112
5-fluoro-1-methyl-3,6-dihydro-2H-pyridine
CID 58799114
1-(2-fluoroethyl)-4-methyl-3,6-dihydro-2H-pyridine
CID 88589110
(E)-N,N-diethyl-3-fluoropent-3-en-2-amine
CID 89168015
1-propan-2-yl-4-(trifluoromethyl)-3,6-dihydro-2H-pyridine
CID 127668747

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-1-propan-2-yl-3,6-dihydro-2H-pyridine?
The IUPAC name of 4-fluoro-1-propan-2-yl-3,6-dihydro-2H-pyridine (CID 166157383) is 4-fluoro-1-propan-2-yl-3,6-dihydro-2H-pyridine.
What is the SMILES notation for 4-fluoro-1-propan-2-yl-3,6-dihydro-2H-pyridine?
The canonical SMILES for 4-fluoro-1-propan-2-yl-3,6-dihydro-2H-pyridine is CC(C)N1CC=C(F)CC1.
What is the InChIKey of 4-fluoro-1-propan-2-yl-3,6-dihydro-2H-pyridine?
The InChIKey is XBZSTDDFWDUJCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14FN/c1-7(2)10-5-3-8(9)4-6-10/h3,7H,4-6H2,1-2H3.
What are the key properties of 4-fluoro-1-propan-2-yl-3,6-dihydro-2H-pyridine?
4-fluoro-1-propan-2-yl-3,6-dihydro-2H-pyridine has a molecular weight of 143.21 g/mol, XLogP of 1.95, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1-propan-2-yl-3,6-dihydro-2H-pyridine is sourced from PubChem (CID 166157383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).