4-methyl-5H-indeno[1,2-b][1,8]naphthyridine

C16H12N2 — CID 154188379

IUPAC4-methyl-5H-indeno[1,2-b][1,8]naphthyridine
SMILESCc1ccnc2c1CC1=Cc3ccccc3C1=N2
InChIInChI=1S/C16H12N2/c1-10-6-7-17-16-14(10)9-12-8-11-4-2-3-5-13(11)15(12)18-16/h2-8H,9H2,1H3
InChIKeyZEEWBCWEDKCMLA-UHFFFAOYSA-N
MW232.29 g/mol
LogP3.46
Rot. Bonds

About 4-methyl-5H-indeno[1,2-b][1,8]naphthyridine

4-methyl-5H-indeno[1,2-b][1,8]naphthyridine (PubChem CID 154188379) has the molecular formula C16H12N2 and a molecular weight of 232.29 g/mol. Its IUPAC name is 4-methyl-5H-indeno[1,2-b][1,8]naphthyridine.

Molecular Properties

Compound Name4-methyl-5H-indeno[1,2-b][1,8]naphthyridine
PubChem CID154188379
Molecular FormulaC16H12N2
Molecular Weight232.29 g/mol
Exact Mass232.10
IUPAC Name4-methyl-5H-indeno[1,2-b][1,8]naphthyridine
SMILESCc1ccnc2c1CC1=Cc3ccccc3C1=N2
InChIInChI=1S/C16H12N2/c1-10-6-7-17-16-14(10)9-12-8-11-4-2-3-5-13(11)15(12)18-16/h2-8H,9H2,1H3
InChIKeyZEEWBCWEDKCMLA-UHFFFAOYSA-N
XLogP3.46
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl 4H-indeno[1,2-b]pyridine-3-carboxylate
CID 141103661
CID 131862894
CID 131862894
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2-[4-[4-(aminomethyl)-3-fluorophenyl]-3H-pyrrolo[2,3-b]pyridin-2-yl]aniline
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indeno[1,2-b]indole
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10,13-dimethyltetracyclo[14.4.0.02,7.09,14]icosa-1(20),2,4,6,9,11,13,16,18-nonaene
CID 10755502
3,6-bis(2-methylphenyl)-1,2,4,5-tetrazine;ethane
CID 145320903
2-fluoro-3-(2-fluorophenyl)-4-methylpyridine
CID 46312589
4,8-dimethyl-1H-naphthalen-2-one
CID 158508718
4-(chloromethyl)-2-(2-methylphenyl)pyrimidine
CID 62747241
3-(2-cyclobutylphenyl)-4-methylpyridin-2-amine
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CID 162162492

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5H-indeno[1,2-b][1,8]naphthyridine?
The IUPAC name of 4-methyl-5H-indeno[1,2-b][1,8]naphthyridine (CID 154188379) is 4-methyl-5H-indeno[1,2-b][1,8]naphthyridine.
What is the SMILES notation for 4-methyl-5H-indeno[1,2-b][1,8]naphthyridine?
The canonical SMILES for 4-methyl-5H-indeno[1,2-b][1,8]naphthyridine is Cc1ccnc2c1CC1=Cc3ccccc3C1=N2.
What is the InChIKey of 4-methyl-5H-indeno[1,2-b][1,8]naphthyridine?
The InChIKey is ZEEWBCWEDKCMLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2/c1-10-6-7-17-16-14(10)9-12-8-11-4-2-3-5-13(11)15(12)18-16/h2-8H,9H2,1H3.
What are the key properties of 4-methyl-5H-indeno[1,2-b][1,8]naphthyridine?
4-methyl-5H-indeno[1,2-b][1,8]naphthyridine has a molecular weight of 232.29 g/mol, XLogP of 3.46, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5H-indeno[1,2-b][1,8]naphthyridine is sourced from PubChem (CID 154188379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).