6-(1-ethyl-3-methylpyrazol-4-yl)-4-methyl-2-(3-methyl-1H-indol-4-yl)-7,8-dihydro-5H-1,6-naphthyridine

C24H27N5 — CID 91618189

IUPAC6-(1-ethyl-3-methylpyrazol-4-yl)-4-methyl-2-(3-methyl-1H-indol-4-yl)-7,8-dihydro-5H-1,6-naphthyridine
SMILESCCn1cc(N2CCc3nc(-c4cccc5[nH]cc(C)c45)cc(C)c3C2)c(C)n1
InChIInChI=1S/C24H27N5/c1-5-29-14-23(17(4)27-29)28-10-9-20-19(13-28)15(2)11-22(26-20)18-7-6-8-21-24(18)16(3)12-25-21/h6-8,11-12,14,25H,5,9-10,13H2,1-4H3
InChIKeyURWGAHODXDKFPX-UHFFFAOYSA-N
MW385.52 g/mol
LogP4.93
Rot. Bonds3

About 6-(1-ethyl-3-methylpyrazol-4-yl)-4-methyl-2-(3-methyl-1H-indol-4-yl)-7,8-dihydro-5H-1,6-naphthyridine

6-(1-ethyl-3-methylpyrazol-4-yl)-4-methyl-2-(3-methyl-1H-indol-4-yl)-7,8-dihydro-5H-1,6-naphthyridine (PubChem CID 91618189) has the molecular formula C24H27N5 and a molecular weight of 385.52 g/mol. Its IUPAC name is 6-(1-ethyl-3-methylpyrazol-4-yl)-4-methyl-2-(3-methyl-1H-indol-4-yl)-7,8-dihydro-5H-1,6-naphthyridine.

Molecular Properties

Compound Name6-(1-ethyl-3-methylpyrazol-4-yl)-4-methyl-2-(3-methyl-1H-indol-4-yl)-7,8-dihydro-5H-1,6-naphthyridine
PubChem CID91618189
Molecular FormulaC24H27N5
Molecular Weight385.52 g/mol
Exact Mass385.23
IUPAC Name6-(1-ethyl-3-methylpyrazol-4-yl)-4-methyl-2-(3-methyl-1H-indol-4-yl)-7,8-dihydro-5H-1,6-naphthyridine
SMILESCCn1cc(N2CCc3nc(-c4cccc5[nH]cc(C)c45)cc(C)c3C2)c(C)n1
InChIInChI=1S/C24H27N5/c1-5-29-14-23(17(4)27-29)28-10-9-20-19(13-28)15(2)11-22(26-20)18-7-6-8-21-24(18)16(3)12-25-21/h6-8,11-12,14,25H,5,9-10,13H2,1-4H3
InChIKeyURWGAHODXDKFPX-UHFFFAOYSA-N
XLogP4.93
TPSA49.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.52
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(1-ethyl-3-methylpyrazol-4-yl)-4-methyl-2-(3-methyl-1H-indol-4-yl)-7,8-dihydro-5H-1,6-naphthyridine?
The IUPAC name of 6-(1-ethyl-3-methylpyrazol-4-yl)-4-methyl-2-(3-methyl-1H-indol-4-yl)-7,8-dihydro-5H-1,6-naphthyridine (CID 91618189) is 6-(1-ethyl-3-methylpyrazol-4-yl)-4-methyl-2-(3-methyl-1H-indol-4-yl)-7,8-dihydro-5H-1,6-naphthyridine.
What is the SMILES notation for 6-(1-ethyl-3-methylpyrazol-4-yl)-4-methyl-2-(3-methyl-1H-indol-4-yl)-7,8-dihydro-5H-1,6-naphthyridine?
The canonical SMILES for 6-(1-ethyl-3-methylpyrazol-4-yl)-4-methyl-2-(3-methyl-1H-indol-4-yl)-7,8-dihydro-5H-1,6-naphthyridine is CCn1cc(N2CCc3nc(-c4cccc5[nH]cc(C)c45)cc(C)c3C2)c(C)n1.
What is the InChIKey of 6-(1-ethyl-3-methylpyrazol-4-yl)-4-methyl-2-(3-methyl-1H-indol-4-yl)-7,8-dihydro-5H-1,6-naphthyridine?
The InChIKey is URWGAHODXDKFPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N5/c1-5-29-14-23(17(4)27-29)28-10-9-20-19(13-28)15(2)11-22(26-20)18-7-6-8-21-24(18)16(3)12-25-21/h6-8,11-12,14,25H,5,9-10,13H2,1-4H3.
What are the key properties of 6-(1-ethyl-3-methylpyrazol-4-yl)-4-methyl-2-(3-methyl-1H-indol-4-yl)-7,8-dihydro-5H-1,6-naphthyridine?
6-(1-ethyl-3-methylpyrazol-4-yl)-4-methyl-2-(3-methyl-1H-indol-4-yl)-7,8-dihydro-5H-1,6-naphthyridine has a molecular weight of 385.52 g/mol, XLogP of 4.93, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-ethyl-3-methylpyrazol-4-yl)-4-methyl-2-(3-methyl-1H-indol-4-yl)-7,8-dihydro-5H-1,6-naphthyridine is sourced from PubChem (CID 91618189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).