2-(aminomethyl)-5-methoxy-1H-pyridin-4-one

C7H10N2O2 — CID 42625910

IUPAC2-(aminomethyl)-5-methoxy-1H-pyridin-4-one
SMILESCOc1c[nH]c(CN)cc1=O
InChIInChI=1S/C7H10N2O2/c1-11-7-4-9-5(3-8)2-6(7)10/h2,4H,3,8H2,1H3,(H,9,10)
InChIKeyFVLPLGUGJALRJB-UHFFFAOYSA-N
MW154.17 g/mol
LogP-0.16
Rot. Bonds2

About 2-(aminomethyl)-5-methoxy-1H-pyridin-4-one

2-(aminomethyl)-5-methoxy-1H-pyridin-4-one (PubChem CID 42625910) has the molecular formula C7H10N2O2 and a molecular weight of 154.17 g/mol. Its IUPAC name is 2-(aminomethyl)-5-methoxy-1H-pyridin-4-one.

Molecular Properties

Compound Name2-(aminomethyl)-5-methoxy-1H-pyridin-4-one
PubChem CID42625910
Molecular FormulaC7H10N2O2
Molecular Weight154.17 g/mol
Exact Mass154.07
IUPAC Name2-(aminomethyl)-5-methoxy-1H-pyridin-4-one
SMILESCOc1c[nH]c(CN)cc1=O
InChIInChI=1S/C7H10N2O2/c1-11-7-4-9-5(3-8)2-6(7)10/h2,4H,3,8H2,1H3,(H,9,10)
InChIKeyFVLPLGUGJALRJB-UHFFFAOYSA-N
XLogP-0.16
TPSA68.11 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(aminomethyl)-5-methoxy-1H-pyridin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-5-methoxy-1H-pyridin-4-one?
The IUPAC name of 2-(aminomethyl)-5-methoxy-1H-pyridin-4-one (CID 42625910) is 2-(aminomethyl)-5-methoxy-1H-pyridin-4-one.
What is the SMILES notation for 2-(aminomethyl)-5-methoxy-1H-pyridin-4-one?
The canonical SMILES for 2-(aminomethyl)-5-methoxy-1H-pyridin-4-one is COc1c[nH]c(CN)cc1=O.
What is the InChIKey of 2-(aminomethyl)-5-methoxy-1H-pyridin-4-one?
The InChIKey is FVLPLGUGJALRJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2/c1-11-7-4-9-5(3-8)2-6(7)10/h2,4H,3,8H2,1H3,(H,9,10).
What are the key properties of 2-(aminomethyl)-5-methoxy-1H-pyridin-4-one?
2-(aminomethyl)-5-methoxy-1H-pyridin-4-one has a molecular weight of 154.17 g/mol, XLogP of -0.16, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-5-methoxy-1H-pyridin-4-one is sourced from PubChem (CID 42625910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).