4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one

C15H19N3O3 — CID 121337676

IUPAC4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one
SMILESCOC1CCN(C(=O)c2cn(C)c(=O)c3[nH]ccc23)CC1
InChIInChI=1S/C15H19N3O3/c1-17-9-12(11-3-6-16-13(11)15(17)20)14(19)18-7-4-10(21-2)5-8-18/h3,6,9-10,16H,4-5,7-8H2,1-2H3
InChIKeyKFFRKYMJDNFLSJ-UHFFFAOYSA-N
MW289.33 g/mol
LogP1.12
Rot. Bonds2

About 4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one

4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one (PubChem CID 121337676) has the molecular formula C15H19N3O3 and a molecular weight of 289.33 g/mol. Its IUPAC name is 4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one.

Molecular Properties

Compound Name4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one
PubChem CID121337676
Molecular FormulaC15H19N3O3
Molecular Weight289.33 g/mol
Exact Mass289.14
IUPAC Name4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one
SMILESCOC1CCN(C(=O)c2cn(C)c(=O)c3[nH]ccc23)CC1
InChIInChI=1S/C15H19N3O3/c1-17-9-12(11-3-6-16-13(11)15(17)20)14(19)18-7-4-10(21-2)5-8-18/h3,6,9-10,16H,4-5,7-8H2,1-2H3
InChIKeyKFFRKYMJDNFLSJ-UHFFFAOYSA-N
XLogP1.12
TPSA67.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one?
The IUPAC name of 4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one (CID 121337676) is 4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one.
What is the SMILES notation for 4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one?
The canonical SMILES for 4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one is COC1CCN(C(=O)c2cn(C)c(=O)c3[nH]ccc23)CC1.
What is the InChIKey of 4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one?
The InChIKey is KFFRKYMJDNFLSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-17-9-12(11-3-6-16-13(11)15(17)20)14(19)18-7-4-10(21-2)5-8-18/h3,6,9-10,16H,4-5,7-8H2,1-2H3.
What are the key properties of 4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one?
4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one has a molecular weight of 289.33 g/mol, XLogP of 1.12, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxypiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one is sourced from PubChem (CID 121337676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).