8-propyl-3,4-dihydroquinoline

C12H15N — CID 177158602

IUPAC8-propyl-3,4-dihydroquinoline
SMILESCCCc1cccc2c1N=CCC2
InChIInChI=1S/C12H15N/c1-2-5-10-6-3-7-11-8-4-9-13-12(10)11/h3,6-7,9H,2,4-5,8H2,1H3
InChIKeyOYFLBZUQOGUROE-UHFFFAOYSA-N
MW173.26 g/mol
LogP3.29
Rot. Bonds2

About 8-propyl-3,4-dihydroquinoline

8-propyl-3,4-dihydroquinoline (PubChem CID 177158602) has the molecular formula C12H15N and a molecular weight of 173.26 g/mol. Its IUPAC name is 8-propyl-3,4-dihydroquinoline.

Molecular Properties

Compound Name8-propyl-3,4-dihydroquinoline
PubChem CID177158602
Molecular FormulaC12H15N
Molecular Weight173.26 g/mol
Exact Mass173.12
IUPAC Name8-propyl-3,4-dihydroquinoline
SMILESCCCc1cccc2c1N=CCC2
InChIInChI=1S/C12H15N/c1-2-5-10-6-3-7-11-8-4-9-13-12(10)11/h3,6-7,9H,2,4-5,8H2,1H3
InChIKeyOYFLBZUQOGUROE-UHFFFAOYSA-N
XLogP3.29
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(3,4-dihydroquinolin-8-yl)formamide;ethane
CID 143299235
4-propyl-1H-indene
CID 18314956
5-ethyl-3,4-dihydroquinoline
CID 175305665
2-ethoxy-1,3-dipropylbenzene
CID 14665558
2-ethyl-5-propyl-3,4-dihydro-1H-isoquinoline
CID 143173694
2-methyl-4-propyl-1H-inden-1-ide;zirconium
CID 174349249
4-(2-methyl-3-propylphenyl)-2,3-dihydro-1H-indene
CID 142524168
2,3-dipropylpyridine
CID 19593488
methanamine;1-propylnaphthalene
CID 174438724
1-fluoro-5-propylnaphthalene
CID 143275008
2-fluoro-1-methyl-3-propylbenzene
CID 54557935
2-propylphenolate;zirconium(2+);chloride
CID 22137017

Frequently Asked Questions

What is the IUPAC name of 8-propyl-3,4-dihydroquinoline?
The IUPAC name of 8-propyl-3,4-dihydroquinoline (CID 177158602) is 8-propyl-3,4-dihydroquinoline.
What is the SMILES notation for 8-propyl-3,4-dihydroquinoline?
The canonical SMILES for 8-propyl-3,4-dihydroquinoline is CCCc1cccc2c1N=CCC2.
What is the InChIKey of 8-propyl-3,4-dihydroquinoline?
The InChIKey is OYFLBZUQOGUROE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N/c1-2-5-10-6-3-7-11-8-4-9-13-12(10)11/h3,6-7,9H,2,4-5,8H2,1H3.
What are the key properties of 8-propyl-3,4-dihydroquinoline?
8-propyl-3,4-dihydroquinoline has a molecular weight of 173.26 g/mol, XLogP of 3.29, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-propyl-3,4-dihydroquinoline is sourced from PubChem (CID 177158602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).