5-(aminomethyl)-1-methylpyridin-2-one

C7H10N2O — CID 23569318

IUPAC5-(aminomethyl)-1-methylpyridin-2-one
SMILESCn1cc(CN)ccc1=O
InChIInChI=1S/C7H10N2O/c1-9-5-6(4-8)2-3-7(9)10/h2-3,5H,4,8H2,1H3
InChIKeyVEJGZLGNXFRQBP-UHFFFAOYSA-N
MW138.17 g/mol
LogP-0.16
Rot. Bonds1

About 5-(aminomethyl)-1-methylpyridin-2-one

5-(aminomethyl)-1-methylpyridin-2-one (PubChem CID 23569318) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 5-(aminomethyl)-1-methylpyridin-2-one.

Molecular Properties

Compound Name5-(aminomethyl)-1-methylpyridin-2-one
PubChem CID23569318
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name5-(aminomethyl)-1-methylpyridin-2-one
SMILESCn1cc(CN)ccc1=O
InChIInChI=1S/C7H10N2O/c1-9-5-6(4-8)2-3-7(9)10/h2-3,5H,4,8H2,1H3
InChIKeyVEJGZLGNXFRQBP-UHFFFAOYSA-N
XLogP-0.16
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 5-0.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-1-methylpyridin-2-one?
The IUPAC name of 5-(aminomethyl)-1-methylpyridin-2-one (CID 23569318) is 5-(aminomethyl)-1-methylpyridin-2-one.
What is the SMILES notation for 5-(aminomethyl)-1-methylpyridin-2-one?
The canonical SMILES for 5-(aminomethyl)-1-methylpyridin-2-one is Cn1cc(CN)ccc1=O.
What is the InChIKey of 5-(aminomethyl)-1-methylpyridin-2-one?
The InChIKey is VEJGZLGNXFRQBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-9-5-6(4-8)2-3-7(9)10/h2-3,5H,4,8H2,1H3.
What are the key properties of 5-(aminomethyl)-1-methylpyridin-2-one?
5-(aminomethyl)-1-methylpyridin-2-one has a molecular weight of 138.17 g/mol, XLogP of -0.16, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-1-methylpyridin-2-one is sourced from PubChem (CID 23569318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).