4-(3-propylphenyl)-1,2,3,4-tetrahydroquinoline

C18H21N — CID 116545640

IUPAC4-(3-propylphenyl)-1,2,3,4-tetrahydroquinoline
SMILESCCCc1cccc(C2CCNc3ccccc32)c1
InChIInChI=1S/C18H21N/c1-2-6-14-7-5-8-15(13-14)16-11-12-19-18-10-4-3-9-17(16)18/h3-5,7-10,13,16,19H,2,6,11-12H2,1H3
InChIKeyRAMINKNUIWMDJE-UHFFFAOYSA-N
MW251.37 g/mol
LogP4.59
Rot. Bonds3

About 4-(3-propylphenyl)-1,2,3,4-tetrahydroquinoline

4-(3-propylphenyl)-1,2,3,4-tetrahydroquinoline (PubChem CID 116545640) has the molecular formula C18H21N and a molecular weight of 251.37 g/mol. Its IUPAC name is 4-(3-propylphenyl)-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name4-(3-propylphenyl)-1,2,3,4-tetrahydroquinoline
PubChem CID116545640
Molecular FormulaC18H21N
Molecular Weight251.37 g/mol
Exact Mass251.17
IUPAC Name4-(3-propylphenyl)-1,2,3,4-tetrahydroquinoline
SMILESCCCc1cccc(C2CCNc3ccccc32)c1
InChIInChI=1S/C18H21N/c1-2-6-14-7-5-8-15(13-14)16-11-12-19-18-10-4-3-9-17(16)18/h3-5,7-10,13,16,19H,2,6,11-12H2,1H3
InChIKeyRAMINKNUIWMDJE-UHFFFAOYSA-N
XLogP4.59
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-[(4-propylphenyl)methyl]-1,2,3,4-tetrahydroquinoline
CID 63866891
4-(3-propylphenyl)-1,2,3,4-tetrahydroisoquinoline
CID 116545643
2-(3-propylphenyl)-2,3-dihydro-1H-indole
CID 116545623
(4-propylphenyl)-(1,2,3,4-tetrahydroquinolin-4-yl)methanone
CID 116598109
4-[3-fluoro-4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydroquinoline
CID 107290107
2-(3-propylphenyl)cyclobutan-1-amine
CID 116546379
4-(2-tert-butylphenyl)-1,2,3,4-tetrahydroquinoline
CID 155670658
4-[2-(3,4-dimethylphenyl)ethyl]-1,2,3,4-tetrahydroquinoline
CID 63866885
4-[2-(4-ethylphenyl)ethyl]-1,2,3,4-tetrahydroquinoline
CID 63867355
4-(2-methylpyrazol-3-yl)-1,2,3,4-tetrahydroquinoline
CID 106779086
1-bromo-2-(3-propylphenyl)cycloheptane
CID 116545541
4-(1,2,3,4-tetrahydroquinolin-4-yl)-1,3-oxazole
CID 55279661

Frequently Asked Questions

What is the IUPAC name of 4-(3-propylphenyl)-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 4-(3-propylphenyl)-1,2,3,4-tetrahydroquinoline (CID 116545640) is 4-(3-propylphenyl)-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 4-(3-propylphenyl)-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 4-(3-propylphenyl)-1,2,3,4-tetrahydroquinoline is CCCc1cccc(C2CCNc3ccccc32)c1.
What is the InChIKey of 4-(3-propylphenyl)-1,2,3,4-tetrahydroquinoline?
The InChIKey is RAMINKNUIWMDJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N/c1-2-6-14-7-5-8-15(13-14)16-11-12-19-18-10-4-3-9-17(16)18/h3-5,7-10,13,16,19H,2,6,11-12H2,1H3.
What are the key properties of 4-(3-propylphenyl)-1,2,3,4-tetrahydroquinoline?
4-(3-propylphenyl)-1,2,3,4-tetrahydroquinoline has a molecular weight of 251.37 g/mol, XLogP of 4.59, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-propylphenyl)-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 116545640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).