7-methoxy-1-methyl-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline

C15H19N3O — CID 121385724

IUPAC7-methoxy-1-methyl-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline
SMILESCOc1cc2c(cc1-c1cnn(C)c1)CCCN2C
InChIInChI=1S/C15H19N3O/c1-17-6-4-5-11-7-13(12-9-16-18(2)10-12)15(19-3)8-14(11)17/h7-10H,4-6H2,1-3H3
InChIKeyYMTQPRIAAJEJJH-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.48
Rot. Bonds2

About 7-methoxy-1-methyl-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline

7-methoxy-1-methyl-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline (PubChem CID 121385724) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 7-methoxy-1-methyl-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline.

Molecular Properties

Compound Name7-methoxy-1-methyl-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline
PubChem CID121385724
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name7-methoxy-1-methyl-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline
SMILESCOc1cc2c(cc1-c1cnn(C)c1)CCCN2C
InChIInChI=1S/C15H19N3O/c1-17-6-4-5-11-7-13(12-9-16-18(2)10-12)15(19-3)8-14(11)17/h7-10H,4-6H2,1-3H3
InChIKeyYMTQPRIAAJEJJH-UHFFFAOYSA-N
XLogP2.48
TPSA30.29 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

7-cyclopropyl-1-methyl-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline
CID 121372752
1-methyl-6-(1-methylpyrazol-4-yl)-7-methylsulfonyl-3,4-dihydro-2H-quinoline
CID 121385853
6-fluoro-1-methyl-5-(1-methylpyrazol-4-yl)-2,3-dihydroindole
CID 121385606
ethane;1-methyl-7-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline
CID 145058420
acetylene;1-methyl-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline-7-carbonitrile;octane
CID 145091183
7-(difluoromethoxy)-1-hexan-2-yl-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline
CID 162575743
5-fluoro-1-methyl-6-(1-methylpyrazol-4-yl)-2,3-dihydroindole
CID 121385729
1-[4-amino-5-[7-methoxy-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline-1-carboximidoyl]-3,6-dihydro-2H-pyridin-1-yl]ethanone
CID 145091870
ethane;6-(1-ethylpyrazol-4-yl)-1,7-dimethyl-3,4-dihydro-2H-quinoline
CID 176986429
5-fluoro-1-methyl-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline
CID 121385888
4-methoxy-3-(1-methylpyrazol-4-yl)benzaldehyde
CID 82039718
3-bromo-6-methoxy-7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine
CID 158513969

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-1-methyl-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline?
The IUPAC name of 7-methoxy-1-methyl-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline (CID 121385724) is 7-methoxy-1-methyl-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline.
What is the SMILES notation for 7-methoxy-1-methyl-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline?
The canonical SMILES for 7-methoxy-1-methyl-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline is COc1cc2c(cc1-c1cnn(C)c1)CCCN2C.
What is the InChIKey of 7-methoxy-1-methyl-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline?
The InChIKey is YMTQPRIAAJEJJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-17-6-4-5-11-7-13(12-9-16-18(2)10-12)15(19-3)8-14(11)17/h7-10H,4-6H2,1-3H3.
What are the key properties of 7-methoxy-1-methyl-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline?
7-methoxy-1-methyl-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline has a molecular weight of 257.34 g/mol, XLogP of 2.48, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-1-methyl-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinoline is sourced from PubChem (CID 121385724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).