N-[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-3,3-dimethyl-2-oxopyrrolidine-1-carboxamide

C23H26N6O3 — CID 139549480

IUPACN-[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-3,3-dimethyl-2-oxopyrrolidine-1-carboxamide
SMILESCCc1nc(NC(=O)N2CCC(C)(C)C2=O)ccc1Oc1ccnc(-c2cnn(C)c2)c1
InChIInChI=1S/C23H26N6O3/c1-5-17-19(32-16-8-10-24-18(12-16)15-13-25-28(4)14-15)6-7-20(26-17)27-22(31)29-11-9-23(2,3)21(29)30/h6-8,10,12-14H,5,9,11H2,1-4H3,(H,26,27,31)
InChIKeyIDFPNAWCPJVDOX-UHFFFAOYSA-N
MW434.50 g/mol
LogP4.02
Rot. Bonds5

About N-[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-3,3-dimethyl-2-oxopyrrolidine-1-carboxamide

N-[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-3,3-dimethyl-2-oxopyrrolidine-1-carboxamide (PubChem CID 139549480) has the molecular formula C23H26N6O3 and a molecular weight of 434.50 g/mol. Its IUPAC name is N-[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-3,3-dimethyl-2-oxopyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-3,3-dimethyl-2-oxopyrrolidine-1-carboxamide
PubChem CID139549480
Molecular FormulaC23H26N6O3
Molecular Weight434.50 g/mol
Exact Mass434.21
IUPAC NameN-[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-3,3-dimethyl-2-oxopyrrolidine-1-carboxamide
SMILESCCc1nc(NC(=O)N2CCC(C)(C)C2=O)ccc1Oc1ccnc(-c2cnn(C)c2)c1
InChIInChI=1S/C23H26N6O3/c1-5-17-19(32-16-8-10-24-18(12-16)15-13-25-28(4)14-15)6-7-20(26-17)27-22(31)29-11-9-23(2,3)21(29)30/h6-8,10,12-14H,5,9,11H2,1-4H3,(H,26,27,31)
InChIKeyIDFPNAWCPJVDOX-UHFFFAOYSA-N
XLogP4.02
TPSA102.24 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.50
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

3,3-dimethyl-N-[6-methyl-5-[[2-[1-(1-methylpyrrolidin-3-yl)pyrazol-4-yl]-4-pyridinyl]oxy]-2-pyridinyl]-2-oxopyrrolidine-1-carboxamide
CID 146432668
3-methyl-N-[6-methyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-oxo-3-phenylmethoxypyrrolidine-1-carboxamide
CID 146421071
8-acetyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-1-oxo-2,8-diazaspiro[4.5]decane-2-carboxamide
CID 146267954
N-[6-methyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-oxoimidazolidine-1-carboxamide
CID 144709836
3,3-dimethyl-N-[6-methyl-5-[2-(1-methylpyrazol-4-yl)pyrimidin-4-yl]oxy-2-pyridinyl]-2-oxopyrrolidine-1-carboxamide
CID 146421047
N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-1,7-dioxo-2-azaspiro[4.5]decane-2-carboxamide
CID 146268035
N-[6-methyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]acetamide
CID 90403222
3-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-oxoimidazolidine-1-carboxamide
CID 86268217
bis[2-benzyl-4,4-dimethyl-1-[[6-methyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]carbamoyl]-5-oxopyrrolidin-3-yl] carbonate
CID 176900739
2,2-dimethyl-N-[[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]carbamoyl]propanamide
CID 86268065
3-(4-fluorophenyl)-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-oxoimidazolidine-1-carboxamide
CID 90446506
N-[6-ethyl-5-[[2-(2-methyl-4-pyridinyl)-4-pyridinyl]oxy]-2-pyridinyl]-3-(oxan-4-yl)-2-oxoimidazolidine-1-carboxamide
CID 86269027

Frequently Asked Questions

What is the IUPAC name of N-[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-3,3-dimethyl-2-oxopyrrolidine-1-carboxamide?
The IUPAC name of N-[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-3,3-dimethyl-2-oxopyrrolidine-1-carboxamide (CID 139549480) is N-[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-3,3-dimethyl-2-oxopyrrolidine-1-carboxamide.
What is the SMILES notation for N-[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-3,3-dimethyl-2-oxopyrrolidine-1-carboxamide?
The canonical SMILES for N-[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-3,3-dimethyl-2-oxopyrrolidine-1-carboxamide is CCc1nc(NC(=O)N2CCC(C)(C)C2=O)ccc1Oc1ccnc(-c2cnn(C)c2)c1.
What is the InChIKey of N-[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-3,3-dimethyl-2-oxopyrrolidine-1-carboxamide?
The InChIKey is IDFPNAWCPJVDOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N6O3/c1-5-17-19(32-16-8-10-24-18(12-16)15-13-25-28(4)14-15)6-7-20(26-17)27-22(31)29-11-9-23(2,3)21(29)30/h6-8,10,12-14H,5,9,11H2,1-4H3,(H,26,27,31).
What are the key properties of N-[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-3,3-dimethyl-2-oxopyrrolidine-1-carboxamide?
N-[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-3,3-dimethyl-2-oxopyrrolidine-1-carboxamide has a molecular weight of 434.50 g/mol, XLogP of 4.02, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-3,3-dimethyl-2-oxopyrrolidine-1-carboxamide is sourced from PubChem (CID 139549480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).