1-(2-propan-2-ylphenyl)-2H-quinoline

C18H19N — CID 141304438

IUPAC1-(2-propan-2-ylphenyl)-2H-quinoline
SMILESCC(C)c1ccccc1N1CC=Cc2ccccc21
InChIInChI=1S/C18H19N/c1-14(2)16-10-4-6-12-18(16)19-13-7-9-15-8-3-5-11-17(15)19/h3-12,14H,13H2,1-2H3
InChIKeyWSIHXGRBWBXDPZ-UHFFFAOYSA-N
MW249.36 g/mol
LogP4.97
Rot. Bonds2

About 1-(2-propan-2-ylphenyl)-2H-quinoline

1-(2-propan-2-ylphenyl)-2H-quinoline (PubChem CID 141304438) has the molecular formula C18H19N and a molecular weight of 249.36 g/mol. Its IUPAC name is 1-(2-propan-2-ylphenyl)-2H-quinoline.

Molecular Properties

Compound Name1-(2-propan-2-ylphenyl)-2H-quinoline
PubChem CID141304438
Molecular FormulaC18H19N
Molecular Weight249.36 g/mol
Exact Mass249.15
IUPAC Name1-(2-propan-2-ylphenyl)-2H-quinoline
SMILESCC(C)c1ccccc1N1CC=Cc2ccccc21
InChIInChI=1S/C18H19N/c1-14(2)16-10-4-6-12-18(16)19-13-7-9-15-8-3-5-11-17(15)19/h3-12,14H,13H2,1-2H3
InChIKeyWSIHXGRBWBXDPZ-UHFFFAOYSA-N
XLogP4.97
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 54.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-[2,6-di(propan-2-yl)phenyl]-2H-quinoline
CID 141304439
1-methyl-2H-quinoline;hydrate;dihydroiodide
CID 174675157
2-deuterio-1-methyl-2H-quinoline
CID 175790396
2-(2H-quinolin-1-yl)quinoline
CID 149254118
1-(2-propan-2-ylphenyl)pyrrolidine
CID 10607693
2H-quinolin-1-amine;dihydrochloride
CID 141446111
2-propan-2-yl-1-(2-propan-2-ylphenyl)-4,5-dihydroimidazole
CID 142726302
3-amino-1-(2-propan-2-ylphenyl)imidazolidine-2,4-dione
CID 135122846
1-(2H-quinolin-1-yl)isoquinoline
CID 91097773
iridium;1-pentyl-2H-quinoline
CID 157228935
4-(2-propan-2-ylphenyl)morpholine-2,3-dione
CID 117005513
1-(2-propan-2-ylphenyl)piperazine-2,5-dione
CID 64955597

Frequently Asked Questions

What is the IUPAC name of 1-(2-propan-2-ylphenyl)-2H-quinoline?
The IUPAC name of 1-(2-propan-2-ylphenyl)-2H-quinoline (CID 141304438) is 1-(2-propan-2-ylphenyl)-2H-quinoline.
What is the SMILES notation for 1-(2-propan-2-ylphenyl)-2H-quinoline?
The canonical SMILES for 1-(2-propan-2-ylphenyl)-2H-quinoline is CC(C)c1ccccc1N1CC=Cc2ccccc21.
What is the InChIKey of 1-(2-propan-2-ylphenyl)-2H-quinoline?
The InChIKey is WSIHXGRBWBXDPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N/c1-14(2)16-10-4-6-12-18(16)19-13-7-9-15-8-3-5-11-17(15)19/h3-12,14H,13H2,1-2H3.
What are the key properties of 1-(2-propan-2-ylphenyl)-2H-quinoline?
1-(2-propan-2-ylphenyl)-2H-quinoline has a molecular weight of 249.36 g/mol, XLogP of 4.97, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-propan-2-ylphenyl)-2H-quinoline is sourced from PubChem (CID 141304438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).