6-(4-ethylphenyl)-2,3,4,5-tetrahydropyridine

C13H17N — CID 151560856

IUPAC6-(4-ethylphenyl)-2,3,4,5-tetrahydropyridine
SMILESCCc1ccc(C2=NCCCC2)cc1
InChIInChI=1S/C13H17N/c1-2-11-6-8-12(9-7-11)13-5-3-4-10-14-13/h6-9H,2-5,10H2,1H3
InChIKeyQCKSWPVDBTVXIY-UHFFFAOYSA-N
MW187.29 g/mol
LogP3.22
Rot. Bonds2

About 6-(4-ethylphenyl)-2,3,4,5-tetrahydropyridine

6-(4-ethylphenyl)-2,3,4,5-tetrahydropyridine (PubChem CID 151560856) has the molecular formula C13H17N and a molecular weight of 187.29 g/mol. Its IUPAC name is 6-(4-ethylphenyl)-2,3,4,5-tetrahydropyridine.

Molecular Properties

Compound Name6-(4-ethylphenyl)-2,3,4,5-tetrahydropyridine
PubChem CID151560856
Molecular FormulaC13H17N
Molecular Weight187.29 g/mol
Exact Mass187.14
IUPAC Name6-(4-ethylphenyl)-2,3,4,5-tetrahydropyridine
SMILESCCc1ccc(C2=NCCCC2)cc1
InChIInChI=1S/C13H17N/c1-2-11-6-8-12(9-7-11)13-5-3-4-10-14-13/h6-9H,2-5,10H2,1H3
InChIKeyQCKSWPVDBTVXIY-UHFFFAOYSA-N
XLogP3.22
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.29
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-(2,3,4,5-tetrahydropyridin-6-yl)-2,3,4,5-tetrahydropyridine
CID 19101375
1-(4-ethylphenyl)-2-(3,4,5,6-tetrahydro-2H-azepin-7-yl)hydrazine
CID 154685325
5-(3,4-dihydro-2H-pyrrol-5-yl)-N-propylpyridin-2-amine
CID 102540088
6-[4-(4-bromophenyl)sulfonylphenyl]-2,3,4,5-tetrahydropyridine
CID 135162045
N-[(4-ethylphenyl)methyl]-3,4-dihydro-2H-pyrrol-5-amine
CID 106899630
N-butan-2-yl-5-(3,4-dihydro-2H-pyrrol-5-yl)pyridin-2-amine
CID 102540216
3-methyl-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridin-2-amine
CID 102542767
1-ethyl-4-[4-(4-propylphenyl)phenyl]benzene
CID 58975771
1-ethyl-4-[2-[4-[2-[4-[2-[4-[2-[4-[2-(4-ethylphenyl)ethyl]phenyl]ethyl]phenyl]ethyl]phenyl]ethyl]phenyl]ethyl]benzene
CID 102370536
alumane;1,4-diethylbenzene
CID 174296012
1,4-diethylbenzene;ethane
CID 91207141
3-(4-ethylphenyl)-4H-1,2-oxazol-5-one
CID 130170876

Frequently Asked Questions

What is the IUPAC name of 6-(4-ethylphenyl)-2,3,4,5-tetrahydropyridine?
The IUPAC name of 6-(4-ethylphenyl)-2,3,4,5-tetrahydropyridine (CID 151560856) is 6-(4-ethylphenyl)-2,3,4,5-tetrahydropyridine.
What is the SMILES notation for 6-(4-ethylphenyl)-2,3,4,5-tetrahydropyridine?
The canonical SMILES for 6-(4-ethylphenyl)-2,3,4,5-tetrahydropyridine is CCc1ccc(C2=NCCCC2)cc1.
What is the InChIKey of 6-(4-ethylphenyl)-2,3,4,5-tetrahydropyridine?
The InChIKey is QCKSWPVDBTVXIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N/c1-2-11-6-8-12(9-7-11)13-5-3-4-10-14-13/h6-9H,2-5,10H2,1H3.
What are the key properties of 6-(4-ethylphenyl)-2,3,4,5-tetrahydropyridine?
6-(4-ethylphenyl)-2,3,4,5-tetrahydropyridine has a molecular weight of 187.29 g/mol, XLogP of 3.22, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-ethylphenyl)-2,3,4,5-tetrahydropyridine is sourced from PubChem (CID 151560856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).