3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide

C9H13N3O — CID 112696201

IUPAC3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
SMILESCc1nc(C(N)=O)c2n1CCCC2
InChIInChI=1S/C9H13N3O/c1-6-11-8(9(10)13)7-4-2-3-5-12(6)7/h2-5H2,1H3,(H2,10,13)
InChIKeyGXFXOSAGIUTDLQ-UHFFFAOYSA-N
MW179.22 g/mol
LogP0.63
Rot. Bonds1

About 3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide

3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 112696201) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is 3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound Name3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
PubChem CID112696201
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC Name3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
SMILESCc1nc(C(N)=O)c2n1CCCC2
InChIInChI=1S/C9H13N3O/c1-6-11-8(9(10)13)7-4-2-3-5-12(6)7/h2-5H2,1H3,(H2,10,13)
InChIKeyGXFXOSAGIUTDLQ-UHFFFAOYSA-N
XLogP0.63
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of 3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide (CID 112696201) is 3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for 3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for 3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide is Cc1nc(C(N)=O)c2n1CCCC2.
What is the InChIKey of 3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is GXFXOSAGIUTDLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c1-6-11-8(9(10)13)7-4-2-3-5-12(6)7/h2-5H2,1H3,(H2,10,13).
What are the key properties of 3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?
3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 179.22 g/mol, XLogP of 0.63, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 112696201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).