8-fluoro-N-methyl-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide

C12H14FN3O — CID 112552656

IUPAC8-fluoro-N-methyl-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide
SMILESCNC(=O)c1nc(C(C)C)n2cccc(F)c12
InChIInChI=1S/C12H14FN3O/c1-7(2)11-15-9(12(17)14-3)10-8(13)5-4-6-16(10)11/h4-7H,1-3H3,(H,14,17)
InChIKeyWOXRFMLUGXRACH-UHFFFAOYSA-N
MW235.26 g/mol
LogP1.96
Rot. Bonds2

About 8-fluoro-N-methyl-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide

8-fluoro-N-methyl-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 112552656) has the molecular formula C12H14FN3O and a molecular weight of 235.26 g/mol. Its IUPAC name is 8-fluoro-N-methyl-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound Name8-fluoro-N-methyl-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide
PubChem CID112552656
Molecular FormulaC12H14FN3O
Molecular Weight235.26 g/mol
Exact Mass235.11
IUPAC Name8-fluoro-N-methyl-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide
SMILESCNC(=O)c1nc(C(C)C)n2cccc(F)c12
InChIInChI=1S/C12H14FN3O/c1-7(2)11-15-9(12(17)14-3)10-8(13)5-4-6-16(10)11/h4-7H,1-3H3,(H,14,17)
InChIKeyWOXRFMLUGXRACH-UHFFFAOYSA-N
XLogP1.96
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.26
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

8-fluoro-N-methyl-3-propan-2-ylimidazo[1,5-a]pyridine-1-sulfonamide
CID 112552708
3-ethyl-8-fluoro-N,N-dimethylimidazo[1,5-a]pyridine-1-carboxamide
CID 112552244
3-(1-aminoethyl)-8-hydroxyimidazo[1,5-a]pyridine-1-carboxylic acid
CID 117254853
2-amino-1-(8-fluoro-3-methylimidazo[1,2-a]pyridin-2-yl)propan-1-one
CID 84686551
3-(1-aminoethyl)-8-bromoimidazo[1,5-a]pyridine-1-carboxylic acid
CID 117254893
1-chloro-3-propan-2-ylimidazo[1,5-a]pyridin-8-amine
CID 83869184
8-bromo-1-chloro-3-propan-2-ylimidazo[1,5-a]pyridine
CID 83904120
2-(8-fluoro-2-propan-2-ylimidazo[1,2-a]pyridin-3-yl)acetic acid
CID 82529262
2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid
CID 83890443
2,2,2-trifluoro-N-[1-(8-fluoroindolizin-1-yl)-1-oxopropan-2-yl]acetamide
CID 169203297
ethane;2-fluoro-N-methylbenzamide
CID 178102327
2-fluoro-N-methylbenzamide;hydrate
CID 141303255

Frequently Asked Questions

What is the IUPAC name of 8-fluoro-N-methyl-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of 8-fluoro-N-methyl-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide (CID 112552656) is 8-fluoro-N-methyl-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for 8-fluoro-N-methyl-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for 8-fluoro-N-methyl-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide is CNC(=O)c1nc(C(C)C)n2cccc(F)c12.
What is the InChIKey of 8-fluoro-N-methyl-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is WOXRFMLUGXRACH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FN3O/c1-7(2)11-15-9(12(17)14-3)10-8(13)5-4-6-16(10)11/h4-7H,1-3H3,(H,14,17).
What are the key properties of 8-fluoro-N-methyl-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
8-fluoro-N-methyl-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 235.26 g/mol, XLogP of 1.96, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-N-methyl-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 112552656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).