[5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazol-2-yl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone

C14H15N7O2 — CID 169165137

IUPAC[5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazol-2-yl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone
SMILESCc1nn(C)cc1-c1nnc(C(=O)N2CCc3nc[nH]c3C2)o1
InChIInChI=1S/C14H15N7O2/c1-8-9(5-20(2)19-8)12-17-18-13(23-12)14(22)21-4-3-10-11(6-21)16-7-15-10/h5,7H,3-4,6H2,1-2H3,(H,15,16)
InChIKeyIHRGHMYAHRJJQT-UHFFFAOYSA-N
MW313.32 g/mol
LogP0.70
Rot. Bonds2

About [5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazol-2-yl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone

[5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazol-2-yl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone (PubChem CID 169165137) has the molecular formula C14H15N7O2 and a molecular weight of 313.32 g/mol. Its IUPAC name is [5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazol-2-yl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone.

Molecular Properties

Compound Name[5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazol-2-yl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone
PubChem CID169165137
Molecular FormulaC14H15N7O2
Molecular Weight313.32 g/mol
Exact Mass313.13
IUPAC Name[5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazol-2-yl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone
SMILESCc1nn(C)cc1-c1nnc(C(=O)N2CCc3nc[nH]c3C2)o1
InChIInChI=1S/C14H15N7O2/c1-8-9(5-20(2)19-8)12-17-18-13(23-12)14(22)21-4-3-10-11(6-21)16-7-15-10/h5,7H,3-4,6H2,1-2H3,(H,15,16)
InChIKeyIHRGHMYAHRJJQT-UHFFFAOYSA-N
XLogP0.70
TPSA105.73 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.32
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze [5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazol-2-yl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone with MolForge

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Related Compounds

(5-methyl-1,3,4-oxadiazol-2-yl)-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone
CID 169166195
[5-[1-(difluoromethyl)pyrazol-3-yl]-1,3,4-oxadiazol-2-yl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone
CID 169164854
[5-(4-fluoropiperidin-1-yl)-1,3,4-oxadiazol-2-yl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone
CID 169164765
[5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazol-2-yl]-[(4S)-4-(7-phosphanylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
CID 170389829
(4-methylphenyl)-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone
CID 110712760
[2-(2-methoxypropan-2-yl)-4-methyl-1,3-oxazol-5-yl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone
CID 169167282
[2-(2-fluoropropan-2-yl)-4-methyl-1,3-oxazol-5-yl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone
CID 169164728
[(4R)-4-[4-(diiodomethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazol-2-yl]methanone
CID 170389358
[(4S)-4-[4-(diiodomethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazol-2-yl]methanone
CID 170389351
[4-(2-methyltetrazol-5-yl)phenyl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone
CID 72893876
2-chloro-1-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)ethanone
CID 131057090
[3-(1-methylpyrazol-4-yl)phenyl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone
CID 139019991

Frequently Asked Questions

What is the IUPAC name of [5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazol-2-yl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone?
The IUPAC name of [5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazol-2-yl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone (CID 169165137) is [5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazol-2-yl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone.
What is the SMILES notation for [5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazol-2-yl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone?
The canonical SMILES for [5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazol-2-yl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone is Cc1nn(C)cc1-c1nnc(C(=O)N2CCc3nc[nH]c3C2)o1.
What is the InChIKey of [5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazol-2-yl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone?
The InChIKey is IHRGHMYAHRJJQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N7O2/c1-8-9(5-20(2)19-8)12-17-18-13(23-12)14(22)21-4-3-10-11(6-21)16-7-15-10/h5,7H,3-4,6H2,1-2H3,(H,15,16).
What are the key properties of [5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazol-2-yl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone?
[5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazol-2-yl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone has a molecular weight of 313.32 g/mol, XLogP of 0.70, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazol-2-yl]-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone is sourced from PubChem (CID 169165137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).