2-[methyl(pyridin-2-yl)amino]cyclobutan-1-ol

C10H14N2O — CID 126856660

IUPAC2-[methyl(pyridin-2-yl)amino]cyclobutan-1-ol
SMILESCN(c1ccccn1)C1CCC1O
InChIInChI=1S/C10H14N2O/c1-12(8-5-6-9(8)13)10-4-2-3-7-11-10/h2-4,7-9,13H,5-6H2,1H3
InChIKeyXAHAZQFVZLPHOO-UHFFFAOYSA-N
MW178.24 g/mol
LogP1.04
Rot. Bonds2

About 2-[methyl(pyridin-2-yl)amino]cyclobutan-1-ol

2-[methyl(pyridin-2-yl)amino]cyclobutan-1-ol (PubChem CID 126856660) has the molecular formula C10H14N2O and a molecular weight of 178.24 g/mol. Its IUPAC name is 2-[methyl(pyridin-2-yl)amino]cyclobutan-1-ol.

Molecular Properties

Compound Name2-[methyl(pyridin-2-yl)amino]cyclobutan-1-ol
PubChem CID126856660
Molecular FormulaC10H14N2O
Molecular Weight178.24 g/mol
Exact Mass178.11
IUPAC Name2-[methyl(pyridin-2-yl)amino]cyclobutan-1-ol
SMILESCN(c1ccccn1)C1CCC1O
InChIInChI=1S/C10H14N2O/c1-12(8-5-6-9(8)13)10-4-2-3-7-11-10/h2-4,7-9,13H,5-6H2,1H3
InChIKeyXAHAZQFVZLPHOO-UHFFFAOYSA-N
XLogP1.04
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[methyl(pyridin-2-yl)amino]cyclobutan-1-ol?
The IUPAC name of 2-[methyl(pyridin-2-yl)amino]cyclobutan-1-ol (CID 126856660) is 2-[methyl(pyridin-2-yl)amino]cyclobutan-1-ol.
What is the SMILES notation for 2-[methyl(pyridin-2-yl)amino]cyclobutan-1-ol?
The canonical SMILES for 2-[methyl(pyridin-2-yl)amino]cyclobutan-1-ol is CN(c1ccccn1)C1CCC1O.
What is the InChIKey of 2-[methyl(pyridin-2-yl)amino]cyclobutan-1-ol?
The InChIKey is XAHAZQFVZLPHOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-12(8-5-6-9(8)13)10-4-2-3-7-11-10/h2-4,7-9,13H,5-6H2,1H3.
What are the key properties of 2-[methyl(pyridin-2-yl)amino]cyclobutan-1-ol?
2-[methyl(pyridin-2-yl)amino]cyclobutan-1-ol has a molecular weight of 178.24 g/mol, XLogP of 1.04, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(pyridin-2-yl)amino]cyclobutan-1-ol is sourced from PubChem (CID 126856660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).