8-methyl-5,6,7,8-tetrahydro-1H-quinolin-2-one

C10H13NO — CID 24962995

IUPAC8-methyl-5,6,7,8-tetrahydro-1H-quinolin-2-one
SMILESCC1CCCc2ccc(=O)[nH]c21
InChIInChI=1S/C10H13NO/c1-7-3-2-4-8-5-6-9(12)11-10(7)8/h5-7H,2-4H2,1H3,(H,11,12)
InChIKeyHNVUDIAFUDEDRR-UHFFFAOYSA-N
MW163.22 g/mol
LogP1.81
Rot. Bonds

About 8-methyl-5,6,7,8-tetrahydro-1H-quinolin-2-one

8-methyl-5,6,7,8-tetrahydro-1H-quinolin-2-one (PubChem CID 24962995) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is 8-methyl-5,6,7,8-tetrahydro-1H-quinolin-2-one.

Molecular Properties

Compound Name8-methyl-5,6,7,8-tetrahydro-1H-quinolin-2-one
PubChem CID24962995
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name8-methyl-5,6,7,8-tetrahydro-1H-quinolin-2-one
SMILESCC1CCCc2ccc(=O)[nH]c21
InChIInChI=1S/C10H13NO/c1-7-3-2-4-8-5-6-9(12)11-10(7)8/h5-7H,2-4H2,1H3,(H,11,12)
InChIKeyHNVUDIAFUDEDRR-UHFFFAOYSA-N
XLogP1.81
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-5,6,7,8-tetrahydro-1H-quinolin-2-one?
The IUPAC name of 8-methyl-5,6,7,8-tetrahydro-1H-quinolin-2-one (CID 24962995) is 8-methyl-5,6,7,8-tetrahydro-1H-quinolin-2-one.
What is the SMILES notation for 8-methyl-5,6,7,8-tetrahydro-1H-quinolin-2-one?
The canonical SMILES for 8-methyl-5,6,7,8-tetrahydro-1H-quinolin-2-one is CC1CCCc2ccc(=O)[nH]c21.
What is the InChIKey of 8-methyl-5,6,7,8-tetrahydro-1H-quinolin-2-one?
The InChIKey is HNVUDIAFUDEDRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO/c1-7-3-2-4-8-5-6-9(12)11-10(7)8/h5-7H,2-4H2,1H3,(H,11,12).
What are the key properties of 8-methyl-5,6,7,8-tetrahydro-1H-quinolin-2-one?
8-methyl-5,6,7,8-tetrahydro-1H-quinolin-2-one has a molecular weight of 163.22 g/mol, XLogP of 1.81, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-5,6,7,8-tetrahydro-1H-quinolin-2-one is sourced from PubChem (CID 24962995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).