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

C20H21N3 — CID 24731725

IUPAC3-methyl-7-(2-phenylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine
SMILESCc1cnc2nc3c(cc2c1)CN(CCc1ccccc1)CC3
InChIInChI=1S/C20H21N3/c1-15-11-17-12-18-14-23(9-7-16-5-3-2-4-6-16)10-8-19(18)22-20(17)21-13-15/h2-6,11-13H,7-10,14H2,1H3
InChIKeyNVGNVITWYCDSGV-UHFFFAOYSA-N
MW303.41 g/mol
LogP3.54
Rot. Bonds3

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

3-methyl-7-(2-phenylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine (PubChem CID 24731725) has the molecular formula C20H21N3 and a molecular weight of 303.41 g/mol. Its IUPAC name is 3-methyl-7-(2-phenylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine.

Molecular Properties

Compound Name3-methyl-7-(2-phenylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine
PubChem CID24731725
Molecular FormulaC20H21N3
Molecular Weight303.41 g/mol
Exact Mass303.17
IUPAC Name3-methyl-7-(2-phenylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine
SMILESCc1cnc2nc3c(cc2c1)CN(CCc1ccccc1)CC3
InChIInChI=1S/C20H21N3/c1-15-11-17-12-18-14-23(9-7-16-5-3-2-4-6-16)10-8-19(18)22-20(17)21-13-15/h2-6,11-13H,7-10,14H2,1H3
InChIKeyNVGNVITWYCDSGV-UHFFFAOYSA-N
XLogP3.54
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-7-(2-phenylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine?
The IUPAC name of 3-methyl-7-(2-phenylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine (CID 24731725) is 3-methyl-7-(2-phenylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine.
What is the SMILES notation for 3-methyl-7-(2-phenylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine?
The canonical SMILES for 3-methyl-7-(2-phenylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine is Cc1cnc2nc3c(cc2c1)CN(CCc1ccccc1)CC3.
What is the InChIKey of 3-methyl-7-(2-phenylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine?
The InChIKey is NVGNVITWYCDSGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3/c1-15-11-17-12-18-14-23(9-7-16-5-3-2-4-6-16)10-8-19(18)22-20(17)21-13-15/h2-6,11-13H,7-10,14H2,1H3.
What are the key properties of 3-methyl-7-(2-phenylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine?
3-methyl-7-(2-phenylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine has a molecular weight of 303.41 g/mol, XLogP of 3.54, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-7-(2-phenylethyl)-8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridine is sourced from PubChem (CID 24731725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).