7-[(2-methyl-1,3-dihydroisoindol-5-yl)methyl]-6,8-dihydro-5H-1,7-naphthyridine

C18H21N3 — CID 155400140

IUPAC7-[(2-methyl-1,3-dihydroisoindol-5-yl)methyl]-6,8-dihydro-5H-1,7-naphthyridine
SMILESCN1Cc2ccc(CN3CCc4cccnc4C3)cc2C1
InChIInChI=1S/C18H21N3/c1-20-11-16-5-4-14(9-17(16)12-20)10-21-8-6-15-3-2-7-19-18(15)13-21/h2-5,7,9H,6,8,10-13H2,1H3
InChIKeyGPFBDUWIDQXPGH-UHFFFAOYSA-N
MW279.39 g/mol
LogP2.59
Rot. Bonds2

About 7-[(2-methyl-1,3-dihydroisoindol-5-yl)methyl]-6,8-dihydro-5H-1,7-naphthyridine

7-[(2-methyl-1,3-dihydroisoindol-5-yl)methyl]-6,8-dihydro-5H-1,7-naphthyridine (PubChem CID 155400140) has the molecular formula C18H21N3 and a molecular weight of 279.39 g/mol. Its IUPAC name is 7-[(2-methyl-1,3-dihydroisoindol-5-yl)methyl]-6,8-dihydro-5H-1,7-naphthyridine.

Molecular Properties

Compound Name7-[(2-methyl-1,3-dihydroisoindol-5-yl)methyl]-6,8-dihydro-5H-1,7-naphthyridine
PubChem CID155400140
Molecular FormulaC18H21N3
Molecular Weight279.39 g/mol
Exact Mass279.17
IUPAC Name7-[(2-methyl-1,3-dihydroisoindol-5-yl)methyl]-6,8-dihydro-5H-1,7-naphthyridine
SMILESCN1Cc2ccc(CN3CCc4cccnc4C3)cc2C1
InChIInChI=1S/C18H21N3/c1-20-11-16-5-4-14(9-17(16)12-20)10-21-8-6-15-3-2-7-19-18(15)13-21/h2-5,7,9H,6,8,10-13H2,1H3
InChIKeyGPFBDUWIDQXPGH-UHFFFAOYSA-N
XLogP2.59
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 7-[(2-methyl-1,3-dihydroisoindol-5-yl)methyl]-6,8-dihydro-5H-1,7-naphthyridine with MolForge

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Related Compounds

2-methyl-6-[(4-methylpiperazin-1-yl)methyl]-3,4-dihydro-1H-isoquinoline
CID 143655275
2-benzyl-6-ethyl-3,4-dihydro-1H-isoquinoline
CID 15519082
2-benzyl-6-ethyl-3,4-dihydro-1H-isoquinoline;ethane
CID 145118805
7-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1-methyl-2H-quinoline
CID 134458413
(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methylphosphane
CID 155201597
2-[(2-methylpyrimidin-5-yl)methyl]-3,4-dihydro-1H-isoquinoline
CID 140988917
[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-pyridinyl]hydrazine
CID 62471385
2-[(3-ethoxy-4-methoxyphenyl)methyl]-3,4-dihydro-1H-isoquinoline
CID 765023
4-[[3-(6,8-dihydro-5H-1,7-naphthyridin-7-ylsulfonyl)phenyl]methyl]thiomorpholine
CID 59826006
(2-methyl-1,3-dihydroisoindol-5-yl)methanamine
CID 82502825
7-[4-(piperazin-1-ylmethyl)phenyl]sulfonyl-6,8-dihydro-5H-1,7-naphthyridine
CID 59826295
7-[(3-chlorophenyl)methyl]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
CID 69329064

Frequently Asked Questions

What is the IUPAC name of 7-[(2-methyl-1,3-dihydroisoindol-5-yl)methyl]-6,8-dihydro-5H-1,7-naphthyridine?
The IUPAC name of 7-[(2-methyl-1,3-dihydroisoindol-5-yl)methyl]-6,8-dihydro-5H-1,7-naphthyridine (CID 155400140) is 7-[(2-methyl-1,3-dihydroisoindol-5-yl)methyl]-6,8-dihydro-5H-1,7-naphthyridine.
What is the SMILES notation for 7-[(2-methyl-1,3-dihydroisoindol-5-yl)methyl]-6,8-dihydro-5H-1,7-naphthyridine?
The canonical SMILES for 7-[(2-methyl-1,3-dihydroisoindol-5-yl)methyl]-6,8-dihydro-5H-1,7-naphthyridine is CN1Cc2ccc(CN3CCc4cccnc4C3)cc2C1.
What is the InChIKey of 7-[(2-methyl-1,3-dihydroisoindol-5-yl)methyl]-6,8-dihydro-5H-1,7-naphthyridine?
The InChIKey is GPFBDUWIDQXPGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3/c1-20-11-16-5-4-14(9-17(16)12-20)10-21-8-6-15-3-2-7-19-18(15)13-21/h2-5,7,9H,6,8,10-13H2,1H3.
What are the key properties of 7-[(2-methyl-1,3-dihydroisoindol-5-yl)methyl]-6,8-dihydro-5H-1,7-naphthyridine?
7-[(2-methyl-1,3-dihydroisoindol-5-yl)methyl]-6,8-dihydro-5H-1,7-naphthyridine has a molecular weight of 279.39 g/mol, XLogP of 2.59, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(2-methyl-1,3-dihydroisoindol-5-yl)methyl]-6,8-dihydro-5H-1,7-naphthyridine is sourced from PubChem (CID 155400140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).