3-(3-methoxypiperidine-1-carbonyl)-1,5,7-trimethylpyrrolo[3,2-c]pyridin-4-one

C17H23N3O3 — CID 155351860

IUPAC3-(3-methoxypiperidine-1-carbonyl)-1,5,7-trimethylpyrrolo[3,2-c]pyridin-4-one
SMILESCOC1CCCN(C(=O)c2cn(C)c3c(C)cn(C)c(=O)c23)C1
InChIInChI=1S/C17H23N3O3/c1-11-8-19(3)17(22)14-13(10-18(2)15(11)14)16(21)20-7-5-6-12(9-20)23-4/h8,10,12H,5-7,9H2,1-4H3
InChIKeyPZSIGGVKUREQDW-UHFFFAOYSA-N
MW317.39 g/mol
LogP1.44
Rot. Bonds2

About 3-(3-methoxypiperidine-1-carbonyl)-1,5,7-trimethylpyrrolo[3,2-c]pyridin-4-one

3-(3-methoxypiperidine-1-carbonyl)-1,5,7-trimethylpyrrolo[3,2-c]pyridin-4-one (PubChem CID 155351860) has the molecular formula C17H23N3O3 and a molecular weight of 317.39 g/mol. Its IUPAC name is 3-(3-methoxypiperidine-1-carbonyl)-1,5,7-trimethylpyrrolo[3,2-c]pyridin-4-one.

Molecular Properties

Compound Name3-(3-methoxypiperidine-1-carbonyl)-1,5,7-trimethylpyrrolo[3,2-c]pyridin-4-one
PubChem CID155351860
Molecular FormulaC17H23N3O3
Molecular Weight317.39 g/mol
Exact Mass317.17
IUPAC Name3-(3-methoxypiperidine-1-carbonyl)-1,5,7-trimethylpyrrolo[3,2-c]pyridin-4-one
SMILESCOC1CCCN(C(=O)c2cn(C)c3c(C)cn(C)c(=O)c23)C1
InChIInChI=1S/C17H23N3O3/c1-11-8-19(3)17(22)14-13(10-18(2)15(11)14)16(21)20-7-5-6-12(9-20)23-4/h8,10,12H,5-7,9H2,1-4H3
InChIKeyPZSIGGVKUREQDW-UHFFFAOYSA-N
XLogP1.44
TPSA56.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-[3-(difluoromethoxy)azetidine-1-carbonyl]-1,5,7-trimethylpyrrolo[3,2-c]pyridin-4-one
CID 155351898
3-[7,7-difluoro-6-(4-methoxyphenyl)-3-azabicyclo[4.1.0]heptane-3-carbonyl]-1,5,7-trimethylpyrrolo[3,2-c]pyridin-4-one
CID 155351981
(4-hydroxy-2-methylphenyl)-(3-methoxypiperidin-1-yl)methanone
CID 103865425
1,5,7-trimethyl-3-(2-phenylazetidine-1-carbonyl)pyrrolo[3,2-c]pyridin-4-one
CID 155351753
4-(3-methoxypiperidine-1-carbonyl)-1-methylpyridin-2-one
CID 113231198
(2-chloro-4,5-difluorophenyl)-(3-methoxypiperidin-1-yl)methanone
CID 91830057
3-(2-benzylpiperidine-1-carbonyl)-1,5,7-trimethylpyrrolo[3,2-c]pyridin-4-one
CID 155351853
(4-chloro-6-methyl-3-pyridinyl)-(3-methoxypiperidin-1-yl)methanone
CID 103878889
[(3S)-3-methoxypiperidin-1-yl]-(2-propan-2-yloxyphenyl)methanone
CID 95352949
(2,5-dimethylphenyl)-[(3S)-3-methoxypyrrolidin-1-yl]methanone
CID 166697905
(2-chlorofuran-3-yl)-(3-methoxypiperidin-1-yl)methanone
CID 106687373
(3-methoxypiperidin-1-yl)-[5-methyl-2-(1,2,4-triazol-4-yl)phenyl]methanone
CID 136539554

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxypiperidine-1-carbonyl)-1,5,7-trimethylpyrrolo[3,2-c]pyridin-4-one?
The IUPAC name of 3-(3-methoxypiperidine-1-carbonyl)-1,5,7-trimethylpyrrolo[3,2-c]pyridin-4-one (CID 155351860) is 3-(3-methoxypiperidine-1-carbonyl)-1,5,7-trimethylpyrrolo[3,2-c]pyridin-4-one.
What is the SMILES notation for 3-(3-methoxypiperidine-1-carbonyl)-1,5,7-trimethylpyrrolo[3,2-c]pyridin-4-one?
The canonical SMILES for 3-(3-methoxypiperidine-1-carbonyl)-1,5,7-trimethylpyrrolo[3,2-c]pyridin-4-one is COC1CCCN(C(=O)c2cn(C)c3c(C)cn(C)c(=O)c23)C1.
What is the InChIKey of 3-(3-methoxypiperidine-1-carbonyl)-1,5,7-trimethylpyrrolo[3,2-c]pyridin-4-one?
The InChIKey is PZSIGGVKUREQDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O3/c1-11-8-19(3)17(22)14-13(10-18(2)15(11)14)16(21)20-7-5-6-12(9-20)23-4/h8,10,12H,5-7,9H2,1-4H3.
What are the key properties of 3-(3-methoxypiperidine-1-carbonyl)-1,5,7-trimethylpyrrolo[3,2-c]pyridin-4-one?
3-(3-methoxypiperidine-1-carbonyl)-1,5,7-trimethylpyrrolo[3,2-c]pyridin-4-one has a molecular weight of 317.39 g/mol, XLogP of 1.44, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxypiperidine-1-carbonyl)-1,5,7-trimethylpyrrolo[3,2-c]pyridin-4-one is sourced from PubChem (CID 155351860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).