6-methyl-1-oxo-5,7-dihydro-2H-cyclopenta[c]pyridine-6-carbonitrile

C10H10N2O — CID 166893008

IUPAC6-methyl-1-oxo-5,7-dihydro-2H-cyclopenta[c]pyridine-6-carbonitrile
SMILESCC1(C#N)Cc2cc[nH]c(=O)c2C1
InChIInChI=1S/C10H10N2O/c1-10(6-11)4-7-2-3-12-9(13)8(7)5-10/h2-3H,4-5H2,1H3,(H,12,13)
InChIKeyDYTDIZUFENGJOO-UHFFFAOYSA-N
MW174.20 g/mol
LogP1.00
Rot. Bonds

About 6-methyl-1-oxo-5,7-dihydro-2H-cyclopenta[c]pyridine-6-carbonitrile

6-methyl-1-oxo-5,7-dihydro-2H-cyclopenta[c]pyridine-6-carbonitrile (PubChem CID 166893008) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is 6-methyl-1-oxo-5,7-dihydro-2H-cyclopenta[c]pyridine-6-carbonitrile.

Molecular Properties

Compound Name6-methyl-1-oxo-5,7-dihydro-2H-cyclopenta[c]pyridine-6-carbonitrile
PubChem CID166893008
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC Name6-methyl-1-oxo-5,7-dihydro-2H-cyclopenta[c]pyridine-6-carbonitrile
SMILESCC1(C#N)Cc2cc[nH]c(=O)c2C1
InChIInChI=1S/C10H10N2O/c1-10(6-11)4-7-2-3-12-9(13)8(7)5-10/h2-3H,4-5H2,1H3,(H,12,13)
InChIKeyDYTDIZUFENGJOO-UHFFFAOYSA-N
XLogP1.00
TPSA56.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-1-oxo-5,7-dihydro-2H-cyclopenta[c]pyridine-6-carbonitrile?
The IUPAC name of 6-methyl-1-oxo-5,7-dihydro-2H-cyclopenta[c]pyridine-6-carbonitrile (CID 166893008) is 6-methyl-1-oxo-5,7-dihydro-2H-cyclopenta[c]pyridine-6-carbonitrile.
What is the SMILES notation for 6-methyl-1-oxo-5,7-dihydro-2H-cyclopenta[c]pyridine-6-carbonitrile?
The canonical SMILES for 6-methyl-1-oxo-5,7-dihydro-2H-cyclopenta[c]pyridine-6-carbonitrile is CC1(C#N)Cc2cc[nH]c(=O)c2C1.
What is the InChIKey of 6-methyl-1-oxo-5,7-dihydro-2H-cyclopenta[c]pyridine-6-carbonitrile?
The InChIKey is DYTDIZUFENGJOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O/c1-10(6-11)4-7-2-3-12-9(13)8(7)5-10/h2-3H,4-5H2,1H3,(H,12,13).
What are the key properties of 6-methyl-1-oxo-5,7-dihydro-2H-cyclopenta[c]pyridine-6-carbonitrile?
6-methyl-1-oxo-5,7-dihydro-2H-cyclopenta[c]pyridine-6-carbonitrile has a molecular weight of 174.20 g/mol, XLogP of 1.00, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1-oxo-5,7-dihydro-2H-cyclopenta[c]pyridine-6-carbonitrile is sourced from PubChem (CID 166893008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).