ethane;6-(3-methoxyazetidin-1-yl)pyridine-3-carboxamide

C14H25N3O2 — CID 170568898

IUPACethane;6-(3-methoxyazetidin-1-yl)pyridine-3-carboxamide
SMILESCC.CC.COC1CN(c2ccc(C(N)=O)cn2)C1
InChIInChI=1S/C10H13N3O2.2C2H6/c1-15-8-5-13(6-8)9-3-2-7(4-12-9)10(11)14;2*1-2/h2-4,8H,5-6H2,1H3,(H2,11,14);2*1-2H3
InChIKeyGZLCVHTVDSAORA-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.07
Rot. Bonds3

About ethane;6-(3-methoxyazetidin-1-yl)pyridine-3-carboxamide

ethane;6-(3-methoxyazetidin-1-yl)pyridine-3-carboxamide (PubChem CID 170568898) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is ethane;6-(3-methoxyazetidin-1-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Nameethane;6-(3-methoxyazetidin-1-yl)pyridine-3-carboxamide
PubChem CID170568898
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC Nameethane;6-(3-methoxyazetidin-1-yl)pyridine-3-carboxamide
SMILESCC.CC.COC1CN(c2ccc(C(N)=O)cn2)C1
InChIInChI=1S/C10H13N3O2.2C2H6/c1-15-8-5-13(6-8)9-3-2-7(4-12-9)10(11)14;2*1-2/h2-4,8H,5-6H2,1H3,(H2,11,14);2*1-2H3
InChIKeyGZLCVHTVDSAORA-UHFFFAOYSA-N
XLogP2.07
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethane;6-(3-methoxyazetidin-1-yl)pyridine-3-carboxamide?
The IUPAC name of ethane;6-(3-methoxyazetidin-1-yl)pyridine-3-carboxamide (CID 170568898) is ethane;6-(3-methoxyazetidin-1-yl)pyridine-3-carboxamide.
What is the SMILES notation for ethane;6-(3-methoxyazetidin-1-yl)pyridine-3-carboxamide?
The canonical SMILES for ethane;6-(3-methoxyazetidin-1-yl)pyridine-3-carboxamide is CC.CC.COC1CN(c2ccc(C(N)=O)cn2)C1.
What is the InChIKey of ethane;6-(3-methoxyazetidin-1-yl)pyridine-3-carboxamide?
The InChIKey is GZLCVHTVDSAORA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2.2C2H6/c1-15-8-5-13(6-8)9-3-2-7(4-12-9)10(11)14;2*1-2/h2-4,8H,5-6H2,1H3,(H2,11,14);2*1-2H3.
What are the key properties of ethane;6-(3-methoxyazetidin-1-yl)pyridine-3-carboxamide?
ethane;6-(3-methoxyazetidin-1-yl)pyridine-3-carboxamide has a molecular weight of 267.37 g/mol, XLogP of 2.07, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-(3-methoxyazetidin-1-yl)pyridine-3-carboxamide is sourced from PubChem (CID 170568898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).