3-methyl-7-(2-thiophen-2-ylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine

C18H19N3S — CID 24731734

IUPAC3-methyl-7-(2-thiophen-2-ylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine
SMILESCc1cnc2nc3c(cc2c1)CN(CCc1cccs1)CC3
InChIInChI=1S/C18H19N3S/c1-13-9-14-10-15-12-21(6-4-16-3-2-8-22-16)7-5-17(15)20-18(14)19-11-13/h2-3,8-11H,4-7,12H2,1H3
InChIKeyLTSDYYBTFXICQK-UHFFFAOYSA-N
MW309.44 g/mol
LogP3.60
Rot. Bonds3

About 3-methyl-7-(2-thiophen-2-ylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine

3-methyl-7-(2-thiophen-2-ylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine (PubChem CID 24731734) has the molecular formula C18H19N3S and a molecular weight of 309.44 g/mol. Its IUPAC name is 3-methyl-7-(2-thiophen-2-ylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine.

Molecular Properties

Compound Name3-methyl-7-(2-thiophen-2-ylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine
PubChem CID24731734
Molecular FormulaC18H19N3S
Molecular Weight309.44 g/mol
Exact Mass309.13
IUPAC Name3-methyl-7-(2-thiophen-2-ylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine
SMILESCc1cnc2nc3c(cc2c1)CN(CCc1cccs1)CC3
InChIInChI=1S/C18H19N3S/c1-13-9-14-10-15-12-21(6-4-16-3-2-8-22-16)7-5-17(15)20-18(14)19-11-13/h2-3,8-11H,4-7,12H2,1H3
InChIKeyLTSDYYBTFXICQK-UHFFFAOYSA-N
XLogP3.60
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.44
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-methyl-7-(2-thiophen-2-ylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine with MolForge

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Related Compounds

3-methyl-7-(2-phenylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine
CID 24731725
7-[2-(3,4-dimethoxyphenyl)ethyl]-3-methyl-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine
CID 24731729
7-methyl-2-(2-thiophen-2-ylethyl)-3,4-dihydro-1H-isoquinoline
CID 175409113
3-chloro-7-(2-pyridin-2-ylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine
CID 24731787
2-(2-thiophen-2-ylethyl)-3,4-dihydro-1H-isoquinolin-5-amine
CID 63775160
5-[(3-bromo-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridin-7-yl)methyl]-3-methyl-1,2,4-oxadiazole
CID 163355183
4-[2-(8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridin-7-yl)ethyl]-N,N-dimethylaniline
CID 24731654
7-[2-(4-chlorophenyl)ethyl]-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine
CID 24731639
6-[(2,4-dimethylphenyl)methyl]-2-thiophen-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24928690
3,5-dimethyl-1-[1-(2-thiophen-2-ylethyl)azetidin-3-yl]pyrazole
CID 56781747
(2S)-2-[(4-methylpyrazol-1-yl)methyl]-4-(2-thiophen-2-ylethyl)morpholine
CID 95301599
N-[1-(2-thiophen-2-ylethyl)piperidin-4-ylidene]hydroxylamine
CID 63775315

Frequently Asked Questions

What is the IUPAC name of 3-methyl-7-(2-thiophen-2-ylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine?
The IUPAC name of 3-methyl-7-(2-thiophen-2-ylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine (CID 24731734) is 3-methyl-7-(2-thiophen-2-ylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine.
What is the SMILES notation for 3-methyl-7-(2-thiophen-2-ylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine?
The canonical SMILES for 3-methyl-7-(2-thiophen-2-ylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine is Cc1cnc2nc3c(cc2c1)CN(CCc1cccs1)CC3.
What is the InChIKey of 3-methyl-7-(2-thiophen-2-ylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine?
The InChIKey is LTSDYYBTFXICQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3S/c1-13-9-14-10-15-12-21(6-4-16-3-2-8-22-16)7-5-17(15)20-18(14)19-11-13/h2-3,8-11H,4-7,12H2,1H3.
What are the key properties of 3-methyl-7-(2-thiophen-2-ylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine?
3-methyl-7-(2-thiophen-2-ylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine has a molecular weight of 309.44 g/mol, XLogP of 3.60, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-7-(2-thiophen-2-ylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine is sourced from PubChem (CID 24731734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).