8-methyl-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-6-(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline

C19H18F3N3 — CID 136645342

IUPAC8-methyl-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-6-(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline
SMILESCc1cc(C(F)(F)F)c2ccc3cc(C4=CCN(C)CC4)nc3c2[nH]1
InChIInChI=1S/C19H18F3N3/c1-11-9-15(19(20,21)22)14-4-3-13-10-16(24-17(13)18(14)23-11)12-5-7-25(2)8-6-12/h3-5,9-10,23H,6-8H2,1-2H3
InChIKeySIBAYXZZQACJSI-UHFFFAOYSA-N
MW345.37 g/mol
LogP4.76
Rot. Bonds1

About 8-methyl-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-6-(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline

8-methyl-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-6-(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline (PubChem CID 136645342) has the molecular formula C19H18F3N3 and a molecular weight of 345.37 g/mol. Its IUPAC name is 8-methyl-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-6-(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline.

Molecular Properties

Compound Name8-methyl-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-6-(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline
PubChem CID136645342
Molecular FormulaC19H18F3N3
Molecular Weight345.37 g/mol
Exact Mass345.15
IUPAC Name8-methyl-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-6-(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline
SMILESCc1cc(C(F)(F)F)c2ccc3cc(C4=CCN(C)CC4)nc3c2[nH]1
InChIInChI=1S/C19H18F3N3/c1-11-9-15(19(20,21)22)14-4-3-13-10-16(24-17(13)18(14)23-11)12-5-7-25(2)8-6-12/h3-5,9-10,23H,6-8H2,1-2H3
InChIKeySIBAYXZZQACJSI-UHFFFAOYSA-N
XLogP4.76
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.37
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 8-methyl-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-6-(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline with MolForge

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Related Compounds

1',5-dimethyl-3-(trifluoromethyl)spiro[1H-indolo[3,2-c]quinoline-6,4'-piperidine]
CID 19824940
6-[1-(Cyclohexa-1,3-dien-1-ylmethyl)-2,5-dihydropyrrol-3-yl]-2-(trifluoromethyl)-3,4-dihydropyridine
CID 68383162
N-(4,5-difluorocyclohepta-2,4,6-trien-1-yl)-5-methyl-1,2,3,4,9,10-hexahydrobenzo[b][1,6]naphthyridin-8-imine
CID 123397028
2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-6,8-bis(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline
CID 136271335
2-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-6,8-bis(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline
CID 136271336
8-methyl-2-(1-methylpiperidin-4-yl)-6-(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline
CID 136645338
8-methyl-2-(1-methylpiperidin-3-yl)-6-(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline
CID 136645340
8-methyl-2-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-6-(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline
CID 136645344
2-(1-ethyl-3,6-dihydro-2H-pyridin-4-yl)-6,8-bis(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline
CID 145564593
1-butylpiperidine;3,3-difluoro-2H-acridine
CID 160676935
3,6-dimethyl-2-[5-(trifluoromethyl)-1,4-dihydroindol-2-ylidene]-3aH-imidazo[4,5-b]pyridine
CID 162573212
4-[2-(2,6-Difluorocyclohexa-2,4-dien-1-ylidene)-1,7a-dihydroindol-5-yl]-4-ethylimino-1,1,1-trifluorobut-2-en-2-amine
CID 162588769

Frequently Asked Questions

What is the IUPAC name of 8-methyl-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-6-(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline?
The IUPAC name of 8-methyl-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-6-(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline (CID 136645342) is 8-methyl-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-6-(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline.
What is the SMILES notation for 8-methyl-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-6-(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline?
The canonical SMILES for 8-methyl-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-6-(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline is Cc1cc(C(F)(F)F)c2ccc3cc(C4=CCN(C)CC4)nc3c2[nH]1.
What is the InChIKey of 8-methyl-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-6-(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline?
The InChIKey is SIBAYXZZQACJSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18F3N3/c1-11-9-15(19(20,21)22)14-4-3-13-10-16(24-17(13)18(14)23-11)12-5-7-25(2)8-6-12/h3-5,9-10,23H,6-8H2,1-2H3.
What are the key properties of 8-methyl-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-6-(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline?
8-methyl-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-6-(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline has a molecular weight of 345.37 g/mol, XLogP of 4.76, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-6-(trifluoromethyl)-9H-pyrrolo[3,2-h]quinoline is sourced from PubChem (CID 136645342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).