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

C12H19N3O — CID 177263009

IUPAC1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide
SMILESCC(C)(C)c1nc(C(N)=O)n2c1CCCC2
InChIInChI=1S/C12H19N3O/c1-12(2,3)9-8-6-4-5-7-15(8)11(14-9)10(13)16/h4-7H2,1-3H3,(H2,13,16)
InChIKeyLTEZLZZTEAYGHN-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.62
Rot. Bonds1

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

1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide (PubChem CID 177263009) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide
PubChem CID177263009
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide
SMILESCC(C)(C)c1nc(C(N)=O)n2c1CCCC2
InChIInChI=1S/C12H19N3O/c1-12(2,3)9-8-6-4-5-7-15(8)11(14-9)10(13)16/h4-7H2,1-3H3,(H2,13,16)
InChIKeyLTEZLZZTEAYGHN-UHFFFAOYSA-N
XLogP1.62
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4,4-Difluorocyclohexyl)-1,4-dimethylimidazole-2-carboxamide
CID 175397411
2-Propan-2-yl-3,4,6,7,8,9-hexahydropyrazino[1,2-a]benzimidazol-1-one
CID 58043821
3,4,6,7,8,9-Hexahydropyrazino[1,2-a]benzoimidazole-1-one
CID 58044127
1-Tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 59825815
2-Methyl-3,4,6,7,8,9-hexahydropyrazino[1,2-a]benzimidazol-1-one
CID 68096621
1,6-Dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-amine
CID 83865532
1,3,7-Trimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117894999
Ethane;1,3,7-trimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 144791430
1,3-Dimethyl-7-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 144791498
2-Butan-2-yl-3-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
CID 155691709
1,3-Di(propan-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 156455933
3,7-Dimethyl-2-propan-2-yl-5,8-dihydroimidazo[1,2-a]pyrazin-6-one
CID 170274457

Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of 1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide (CID 177263009) is 1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for 1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for 1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide is CC(C)(C)c1nc(C(N)=O)n2c1CCCC2.
What is the InChIKey of 1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide?
The InChIKey is LTEZLZZTEAYGHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-12(2,3)9-8-6-4-5-7-15(8)11(14-9)10(13)16/h4-7H2,1-3H3,(H2,13,16).
What are the key properties of 1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide?
1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide has a molecular weight of 221.30 g/mol, XLogP of 1.62, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 177263009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).