8-methyl-2,9-dihydropyrido[3,4-b]indol-1-one

C12H10N2O — CID 115021368

IUPAC8-methyl-2,9-dihydropyrido[3,4-b]indol-1-one
SMILESCc1cccc2c1[nH]c1c(=O)[nH]ccc12
InChIInChI=1S/C12H10N2O/c1-7-3-2-4-8-9-5-6-13-12(15)11(9)14-10(7)8/h2-6,14H,1H3,(H,13,15)
InChIKeyZTVXPHFVFIZHTP-UHFFFAOYSA-N
MW198.22 g/mol
LogP2.32
Rot. Bonds

About 8-methyl-2,9-dihydropyrido[3,4-b]indol-1-one

8-methyl-2,9-dihydropyrido[3,4-b]indol-1-one (PubChem CID 115021368) has the molecular formula C12H10N2O and a molecular weight of 198.22 g/mol. Its IUPAC name is 8-methyl-2,9-dihydropyrido[3,4-b]indol-1-one.

Molecular Properties

Compound Name8-methyl-2,9-dihydropyrido[3,4-b]indol-1-one
PubChem CID115021368
Molecular FormulaC12H10N2O
Molecular Weight198.22 g/mol
Exact Mass198.08
IUPAC Name8-methyl-2,9-dihydropyrido[3,4-b]indol-1-one
SMILESCc1cccc2c1[nH]c1c(=O)[nH]ccc12
InChIInChI=1S/C12H10N2O/c1-7-3-2-4-8-9-5-6-13-12(15)11(9)14-10(7)8/h2-6,14H,1H3,(H,13,15)
InChIKeyZTVXPHFVFIZHTP-UHFFFAOYSA-N
XLogP2.32
TPSA48.65 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.22
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

8-methyl-1-propyl-2,9-dihydropyrido[3,4-b]indol-3-one
CID 115043749
3-chloro-2-methyl-1,6-dihydropyrrolo[2,3-c]pyridin-7-one
CID 141182186
8,9-dimethyl-2H-pyrido[3,4-b]indol-1-one
CID 115027878
1,7-dihydropyrido[3,4-d]pyrimidine-2,4,8-trione
CID 82409795
7-methyl-9-azaheptacyclo[19.8.0.02,10.03,8.011,20.013,18.023,28]nonacosa-1,3,5,7,10,13,15,17,20,23,25,27-dodecaene-12,19,22,29-tetrone
CID 19431832
4-amino-8-methyl-1H-quinolin-2-one
CID 14627645
4,8-dimethyl-1H-quinoline-2-thione
CID 2118128
2,3-dibromo-1,6-dihydropyrrolo[2,3-c]pyridin-7-one
CID 11185425
5-methyl-9-oxo-10H-acridine-4-carboxamide
CID 23191611
6-methyl-2,5-dihydrotriazolo[4,5-c][1]benzazepine-4,10-dione
CID 18937674
5-amino-2H-isoquinolin-1-one
CID 2072
ethane;8-methyl-2H-isoquinolin-1-one
CID 142940495

Frequently Asked Questions

What is the IUPAC name of 8-methyl-2,9-dihydropyrido[3,4-b]indol-1-one?
The IUPAC name of 8-methyl-2,9-dihydropyrido[3,4-b]indol-1-one (CID 115021368) is 8-methyl-2,9-dihydropyrido[3,4-b]indol-1-one.
What is the SMILES notation for 8-methyl-2,9-dihydropyrido[3,4-b]indol-1-one?
The canonical SMILES for 8-methyl-2,9-dihydropyrido[3,4-b]indol-1-one is Cc1cccc2c1[nH]c1c(=O)[nH]ccc12.
What is the InChIKey of 8-methyl-2,9-dihydropyrido[3,4-b]indol-1-one?
The InChIKey is ZTVXPHFVFIZHTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2O/c1-7-3-2-4-8-9-5-6-13-12(15)11(9)14-10(7)8/h2-6,14H,1H3,(H,13,15).
What are the key properties of 8-methyl-2,9-dihydropyrido[3,4-b]indol-1-one?
8-methyl-2,9-dihydropyrido[3,4-b]indol-1-one has a molecular weight of 198.22 g/mol, XLogP of 2.32, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-2,9-dihydropyrido[3,4-b]indol-1-one is sourced from PubChem (CID 115021368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).