1-propan-2-yl-6-(1-propan-2-ylpyrazol-4-yl)-3,4-dihydro-2H-quinoline

C18H25N3 — CID 177122967

IUPAC1-propan-2-yl-6-(1-propan-2-ylpyrazol-4-yl)-3,4-dihydro-2H-quinoline
SMILESCC(C)N1CCCc2cc(-c3cnn(C(C)C)c3)ccc21
InChIInChI=1S/C18H25N3/c1-13(2)20-9-5-6-16-10-15(7-8-18(16)20)17-11-19-21(12-17)14(3)4/h7-8,10-14H,5-6,9H2,1-4H3
InChIKeyVGKLOOGKAUCVNL-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.29
Rot. Bonds3

About 1-propan-2-yl-6-(1-propan-2-ylpyrazol-4-yl)-3,4-dihydro-2H-quinoline

1-propan-2-yl-6-(1-propan-2-ylpyrazol-4-yl)-3,4-dihydro-2H-quinoline (PubChem CID 177122967) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is 1-propan-2-yl-6-(1-propan-2-ylpyrazol-4-yl)-3,4-dihydro-2H-quinoline.

Molecular Properties

Compound Name1-propan-2-yl-6-(1-propan-2-ylpyrazol-4-yl)-3,4-dihydro-2H-quinoline
PubChem CID177122967
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC Name1-propan-2-yl-6-(1-propan-2-ylpyrazol-4-yl)-3,4-dihydro-2H-quinoline
SMILESCC(C)N1CCCc2cc(-c3cnn(C(C)C)c3)ccc21
InChIInChI=1S/C18H25N3/c1-13(2)20-9-5-6-16-10-15(7-8-18(16)20)17-11-19-21(12-17)14(3)4/h7-8,10-14H,5-6,9H2,1-4H3
InChIKeyVGKLOOGKAUCVNL-UHFFFAOYSA-N
XLogP4.29
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-propan-2-yl-6-(1-propan-2-ylpyrazol-4-yl)-7-(trifluoromethyl)-3,4-dihydro-2H-quinoline
CID 177122886
1-hexan-3-yl-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline
CID 139398312
6-(5-methyl-1H-pyrazol-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline
CID 121382795
6-(1-propan-2-ylpyrazol-4-yl)naphthalene-2-carboxylic acid
CID 172868751
1-propan-2-yl-6-(trifluoromethoxy)-3,4-dihydro-2H-quinoline
CID 146522036
ethane;1-methyl-7-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline
CID 145058420
N-methyl-2-[4-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)pyrazol-1-yl]ethanamine
CID 147895995
2-methyl-4-(1-propan-2-ylpyrazol-4-yl)benzoic acid
CID 162677620
(3R)-3-ethyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline
CID 121382739
ethyl 5-(1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl)-2H-triazole-4-carboxylate
CID 169400109
5-(1-methylpyrazol-4-yl)-2,3-dihydroindol-1-amine
CID 176983699
2-amino-6-oxo-4-(1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl)-1H-pyridine-3,5-dicarboxylic acid
CID 169406115

Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yl-6-(1-propan-2-ylpyrazol-4-yl)-3,4-dihydro-2H-quinoline?
The IUPAC name of 1-propan-2-yl-6-(1-propan-2-ylpyrazol-4-yl)-3,4-dihydro-2H-quinoline (CID 177122967) is 1-propan-2-yl-6-(1-propan-2-ylpyrazol-4-yl)-3,4-dihydro-2H-quinoline.
What is the SMILES notation for 1-propan-2-yl-6-(1-propan-2-ylpyrazol-4-yl)-3,4-dihydro-2H-quinoline?
The canonical SMILES for 1-propan-2-yl-6-(1-propan-2-ylpyrazol-4-yl)-3,4-dihydro-2H-quinoline is CC(C)N1CCCc2cc(-c3cnn(C(C)C)c3)ccc21.
What is the InChIKey of 1-propan-2-yl-6-(1-propan-2-ylpyrazol-4-yl)-3,4-dihydro-2H-quinoline?
The InChIKey is VGKLOOGKAUCVNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-13(2)20-9-5-6-16-10-15(7-8-18(16)20)17-11-19-21(12-17)14(3)4/h7-8,10-14H,5-6,9H2,1-4H3.
What are the key properties of 1-propan-2-yl-6-(1-propan-2-ylpyrazol-4-yl)-3,4-dihydro-2H-quinoline?
1-propan-2-yl-6-(1-propan-2-ylpyrazol-4-yl)-3,4-dihydro-2H-quinoline has a molecular weight of 283.42 g/mol, XLogP of 4.29, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-6-(1-propan-2-ylpyrazol-4-yl)-3,4-dihydro-2H-quinoline is sourced from PubChem (CID 177122967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).