6-benzyl-2-(3,5-difluorophenyl)-4-methyl-7,8-dihydro-5H-1,6-naphthyridine

C22H20F2N2 — CID 122460623

IUPAC6-benzyl-2-(3,5-difluorophenyl)-4-methyl-7,8-dihydro-5H-1,6-naphthyridine
SMILESCc1cc(-c2cc(F)cc(F)c2)nc2c1CN(Cc1ccccc1)CC2
InChIInChI=1S/C22H20F2N2/c1-15-9-22(17-10-18(23)12-19(24)11-17)25-21-7-8-26(14-20(15)21)13-16-5-3-2-4-6-16/h2-6,9-12H,7-8,13-14H2,1H3
InChIKeyNKFYZWDMAGXCDZ-UHFFFAOYSA-N
MW350.41 g/mol
LogP4.89
Rot. Bonds3

About 6-benzyl-2-(3,5-difluorophenyl)-4-methyl-7,8-dihydro-5H-1,6-naphthyridine

6-benzyl-2-(3,5-difluorophenyl)-4-methyl-7,8-dihydro-5H-1,6-naphthyridine (PubChem CID 122460623) has the molecular formula C22H20F2N2 and a molecular weight of 350.41 g/mol. Its IUPAC name is 6-benzyl-2-(3,5-difluorophenyl)-4-methyl-7,8-dihydro-5H-1,6-naphthyridine.

Molecular Properties

Compound Name6-benzyl-2-(3,5-difluorophenyl)-4-methyl-7,8-dihydro-5H-1,6-naphthyridine
PubChem CID122460623
Molecular FormulaC22H20F2N2
Molecular Weight350.41 g/mol
Exact Mass350.16
IUPAC Name6-benzyl-2-(3,5-difluorophenyl)-4-methyl-7,8-dihydro-5H-1,6-naphthyridine
SMILESCc1cc(-c2cc(F)cc(F)c2)nc2c1CN(Cc1ccccc1)CC2
InChIInChI=1S/C22H20F2N2/c1-15-9-22(17-10-18(23)12-19(24)11-17)25-21-7-8-26(14-20(15)21)13-16-5-3-2-4-6-16/h2-6,9-12H,7-8,13-14H2,1H3
InChIKeyNKFYZWDMAGXCDZ-UHFFFAOYSA-N
XLogP4.89
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.41
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 6-benzyl-2-(3,5-difluorophenyl)-4-methyl-7,8-dihydro-5H-1,6-naphthyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(6-benzyl-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)phenol
CID 137299237
2-benzyl-10-chloro-8-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine
CID 121370928
6-benzyl-4-chloro-N-(4-fluoro-3-methylphenyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-amine
CID 94674137
6-benzyl-4-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 59447643
6-benzyl-2-chloro-N,N-dimethyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine
CID 42870418
6-benzyl-4-chloro-2-(chloromethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 81217160
2-(1-benzyl-3,6-dihydro-2H-pyridin-4-yl)-4-(4-fluorophenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine
CID 139636097
6-benzyl-2-(5-chloro-2-fluorophenyl)-N-(3-methyl-4-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine
CID 58865993
6-benzyl-N-(2-fluoro-4-methylsulfonylphenyl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine
CID 151188622
7-benzyl-4-phenyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
CID 58378136
6-[(3-fluoro-4-methylphenyl)methyl]-2-propan-2-yl-3,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one
CID 135918965
5-benzyl-2-(3,4-difluorophenyl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine
CID 122460970

Frequently Asked Questions

What is the IUPAC name of 6-benzyl-2-(3,5-difluorophenyl)-4-methyl-7,8-dihydro-5H-1,6-naphthyridine?
The IUPAC name of 6-benzyl-2-(3,5-difluorophenyl)-4-methyl-7,8-dihydro-5H-1,6-naphthyridine (CID 122460623) is 6-benzyl-2-(3,5-difluorophenyl)-4-methyl-7,8-dihydro-5H-1,6-naphthyridine.
What is the SMILES notation for 6-benzyl-2-(3,5-difluorophenyl)-4-methyl-7,8-dihydro-5H-1,6-naphthyridine?
The canonical SMILES for 6-benzyl-2-(3,5-difluorophenyl)-4-methyl-7,8-dihydro-5H-1,6-naphthyridine is Cc1cc(-c2cc(F)cc(F)c2)nc2c1CN(Cc1ccccc1)CC2.
What is the InChIKey of 6-benzyl-2-(3,5-difluorophenyl)-4-methyl-7,8-dihydro-5H-1,6-naphthyridine?
The InChIKey is NKFYZWDMAGXCDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20F2N2/c1-15-9-22(17-10-18(23)12-19(24)11-17)25-21-7-8-26(14-20(15)21)13-16-5-3-2-4-6-16/h2-6,9-12H,7-8,13-14H2,1H3.
What are the key properties of 6-benzyl-2-(3,5-difluorophenyl)-4-methyl-7,8-dihydro-5H-1,6-naphthyridine?
6-benzyl-2-(3,5-difluorophenyl)-4-methyl-7,8-dihydro-5H-1,6-naphthyridine has a molecular weight of 350.41 g/mol, XLogP of 4.89, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-benzyl-2-(3,5-difluorophenyl)-4-methyl-7,8-dihydro-5H-1,6-naphthyridine is sourced from PubChem (CID 122460623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).