3-(aminomethyl)-4,6-dimethyl-1,2-dihydropyridin-2-ol

C8H14N2O — CID 134216276

IUPAC3-(aminomethyl)-4,6-dimethyl-1,2-dihydropyridin-2-ol
SMILESCC1=CC(C)=C(CN)C(O)N1
InChIInChI=1S/C8H14N2O/c1-5-3-6(2)10-8(11)7(5)4-9/h3,8,10-11H,4,9H2,1-2H3
InChIKeyJUYBNIPCDAQMFF-UHFFFAOYSA-N
MW154.21 g/mol
LogP0.09
Rot. Bonds1

About 3-(aminomethyl)-4,6-dimethyl-1,2-dihydropyridin-2-ol

3-(aminomethyl)-4,6-dimethyl-1,2-dihydropyridin-2-ol (PubChem CID 134216276) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is 3-(aminomethyl)-4,6-dimethyl-1,2-dihydropyridin-2-ol.

Molecular Properties

Compound Name3-(aminomethyl)-4,6-dimethyl-1,2-dihydropyridin-2-ol
PubChem CID134216276
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name3-(aminomethyl)-4,6-dimethyl-1,2-dihydropyridin-2-ol
SMILESCC1=CC(C)=C(CN)C(O)N1
InChIInChI=1S/C8H14N2O/c1-5-3-6(2)10-8(11)7(5)4-9/h3,8,10-11H,4,9H2,1-2H3
InChIKeyJUYBNIPCDAQMFF-UHFFFAOYSA-N
XLogP0.09
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 50.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-4,6-dimethyl-1,2-dihydropyridin-2-ol?
The IUPAC name of 3-(aminomethyl)-4,6-dimethyl-1,2-dihydropyridin-2-ol (CID 134216276) is 3-(aminomethyl)-4,6-dimethyl-1,2-dihydropyridin-2-ol.
What is the SMILES notation for 3-(aminomethyl)-4,6-dimethyl-1,2-dihydropyridin-2-ol?
The canonical SMILES for 3-(aminomethyl)-4,6-dimethyl-1,2-dihydropyridin-2-ol is CC1=CC(C)=C(CN)C(O)N1.
What is the InChIKey of 3-(aminomethyl)-4,6-dimethyl-1,2-dihydropyridin-2-ol?
The InChIKey is JUYBNIPCDAQMFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-5-3-6(2)10-8(11)7(5)4-9/h3,8,10-11H,4,9H2,1-2H3.
What are the key properties of 3-(aminomethyl)-4,6-dimethyl-1,2-dihydropyridin-2-ol?
3-(aminomethyl)-4,6-dimethyl-1,2-dihydropyridin-2-ol has a molecular weight of 154.21 g/mol, XLogP of 0.09, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-4,6-dimethyl-1,2-dihydropyridin-2-ol is sourced from PubChem (CID 134216276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).