4-phenyl-2-propyl-1,2,3,4-tetrahydroquinoline

C18H21N — CID 139220205

IUPAC4-phenyl-2-propyl-1,2,3,4-tetrahydroquinoline
SMILESCCCC1CC(c2ccccc2)c2ccccc2N1
InChIInChI=1S/C18H21N/c1-2-8-15-13-17(14-9-4-3-5-10-14)16-11-6-7-12-18(16)19-15/h3-7,9-12,15,17,19H,2,8,13H2,1H3
InChIKeyLCQYJBIPIXAQPR-UHFFFAOYSA-N
MW251.37 g/mol
LogP4.80
Rot. Bonds3

About 4-phenyl-2-propyl-1,2,3,4-tetrahydroquinoline

4-phenyl-2-propyl-1,2,3,4-tetrahydroquinoline (PubChem CID 139220205) has the molecular formula C18H21N and a molecular weight of 251.37 g/mol. Its IUPAC name is 4-phenyl-2-propyl-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name4-phenyl-2-propyl-1,2,3,4-tetrahydroquinoline
PubChem CID139220205
Molecular FormulaC18H21N
Molecular Weight251.37 g/mol
Exact Mass251.17
IUPAC Name4-phenyl-2-propyl-1,2,3,4-tetrahydroquinoline
SMILESCCCC1CC(c2ccccc2)c2ccccc2N1
InChIInChI=1S/C18H21N/c1-2-8-15-13-17(14-9-4-3-5-10-14)16-11-6-7-12-18(16)19-15/h3-7,9-12,15,17,19H,2,8,13H2,1H3
InChIKeyLCQYJBIPIXAQPR-UHFFFAOYSA-N
XLogP4.80
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 ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-propyl-3,4-dihydro-2H-1,4-benzoxazine
CID 20571251
(1S,3S)-3-phenyl-N-propyl-2,3-dihydro-1H-inden-1-amine
CID 101018229
2-phenyl-1,2,3,4-tetrahydroquinolin-4-amine
CID 73425029
(1R)-1-methyl-3-phenyl-2,3-dihydro-1H-indene
CID 163676750
2-methyl-4-pentyl-1,2,3,4-tetrahydroquinoline
CID 106778499
(5S)-5-phenyl-1,3,4,5-tetrahydro-1-benzazepin-2-one
CID 51669604
8-tetradecyl-7-azabicyclo[4.2.0]octa-1,3,5-triene
CID 21292499
[(2S)-2-phenyl-1,2,3,4-tetrahydroquinolin-4-yl]methyl-tri(propan-2-yl)silane
CID 102388736
4-ethyl-3-methyl-2-phenyl-1,2,3,4-tetrahydroquinoline
CID 142986299
(3aS,5S,9bS)-5-phenyl-3-propyl-1,2,3a,4,5,9b-hexahydrobenzo[e]indole;hydrochloride
CID 70394737
4-(3-propylphenyl)-1,2,3,4-tetrahydroquinoline
CID 116545640
(4-propylcyclohexyl)benzene
CID 155887669

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-2-propyl-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 4-phenyl-2-propyl-1,2,3,4-tetrahydroquinoline (CID 139220205) is 4-phenyl-2-propyl-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 4-phenyl-2-propyl-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 4-phenyl-2-propyl-1,2,3,4-tetrahydroquinoline is CCCC1CC(c2ccccc2)c2ccccc2N1.
What is the InChIKey of 4-phenyl-2-propyl-1,2,3,4-tetrahydroquinoline?
The InChIKey is LCQYJBIPIXAQPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N/c1-2-8-15-13-17(14-9-4-3-5-10-14)16-11-6-7-12-18(16)19-15/h3-7,9-12,15,17,19H,2,8,13H2,1H3.
What are the key properties of 4-phenyl-2-propyl-1,2,3,4-tetrahydroquinoline?
4-phenyl-2-propyl-1,2,3,4-tetrahydroquinoline has a molecular weight of 251.37 g/mol, XLogP of 4.80, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-2-propyl-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 139220205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).