ethane;N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide

C13H25N3O — CID 145225752

IUPACethane;N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide
SMILESCC.CC.CNC(=O)c1cn2c(n1)CCCC2
InChIInChI=1S/C9H13N3O.2C2H6/c1-10-9(13)7-6-12-5-3-2-4-8(12)11-7;2*1-2/h6H,2-5H2,1H3,(H,10,13);2*1-2H3
InChIKeyHMNGYZOTKAYVHN-UHFFFAOYSA-N
MW239.36 g/mol
LogP2.63
Rot. Bonds1

About ethane;N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide

ethane;N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 145225752) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is ethane;N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound Nameethane;N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide
PubChem CID145225752
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Nameethane;N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide
SMILESCC.CC.CNC(=O)c1cn2c(n1)CCCC2
InChIInChI=1S/C9H13N3O.2C2H6/c1-10-9(13)7-6-12-5-3-2-4-8(12)11-7;2*1-2/h6H,2-5H2,1H3,(H,10,13);2*1-2H3
InChIKeyHMNGYZOTKAYVHN-UHFFFAOYSA-N
XLogP2.63
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of ethane;N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide (CID 145225752) is ethane;N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for ethane;N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for ethane;N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide is CC.CC.CNC(=O)c1cn2c(n1)CCCC2.
What is the InChIKey of ethane;N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is HMNGYZOTKAYVHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O.2C2H6/c1-10-9(13)7-6-12-5-3-2-4-8(12)11-7;2*1-2/h6H,2-5H2,1H3,(H,10,13);2*1-2H3.
What are the key properties of ethane;N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide?
ethane;N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 239.36 g/mol, XLogP of 2.63, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 145225752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).