N-[[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]carbamoyl]-2,2-dimethylpropanamide

C22H26N6O3 — CID 86269488

IUPACN-[[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]carbamoyl]-2,2-dimethylpropanamide
SMILESCCc1nc(NC(=O)NC(=O)C(C)(C)C)ccc1Oc1ccnc(-c2cnn(C)c2)c1
InChIInChI=1S/C22H26N6O3/c1-6-16-18(7-8-19(25-16)26-21(30)27-20(29)22(2,3)4)31-15-9-10-23-17(11-15)14-12-24-28(5)13-14/h7-13H,6H2,1-5H3,(H2,25,26,27,29,30)
InChIKeyURZFDLKDKFIRGI-UHFFFAOYSA-N
MW422.49 g/mol
LogP3.93
Rot. Bonds5

About N-[[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]carbamoyl]-2,2-dimethylpropanamide

N-[[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]carbamoyl]-2,2-dimethylpropanamide (PubChem CID 86269488) has the molecular formula C22H26N6O3 and a molecular weight of 422.49 g/mol. Its IUPAC name is N-[[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]carbamoyl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]carbamoyl]-2,2-dimethylpropanamide
PubChem CID86269488
Molecular FormulaC22H26N6O3
Molecular Weight422.49 g/mol
Exact Mass422.21
IUPAC NameN-[[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]carbamoyl]-2,2-dimethylpropanamide
SMILESCCc1nc(NC(=O)NC(=O)C(C)(C)C)ccc1Oc1ccnc(-c2cnn(C)c2)c1
InChIInChI=1S/C22H26N6O3/c1-6-16-18(7-8-19(25-16)26-21(30)27-20(29)22(2,3)4)31-15-9-10-23-17(11-15)14-12-24-28(5)13-14/h7-13H,6H2,1-5H3,(H2,25,26,27,29,30)
InChIKeyURZFDLKDKFIRGI-UHFFFAOYSA-N
XLogP3.93
TPSA111.03 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.49
LogP ≤ 53.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-[[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]carbamoyl]-2,2-dimethylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]carbamoyl]-2,2-dimethylpropanamide?
The IUPAC name of N-[[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]carbamoyl]-2,2-dimethylpropanamide (CID 86269488) is N-[[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]carbamoyl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]carbamoyl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]carbamoyl]-2,2-dimethylpropanamide is CCc1nc(NC(=O)NC(=O)C(C)(C)C)ccc1Oc1ccnc(-c2cnn(C)c2)c1.
What is the InChIKey of N-[[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]carbamoyl]-2,2-dimethylpropanamide?
The InChIKey is URZFDLKDKFIRGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N6O3/c1-6-16-18(7-8-19(25-16)26-21(30)27-20(29)22(2,3)4)31-15-9-10-23-17(11-15)14-12-24-28(5)13-14/h7-13H,6H2,1-5H3,(H2,25,26,27,29,30).
What are the key properties of N-[[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]carbamoyl]-2,2-dimethylpropanamide?
N-[[6-ethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]carbamoyl]-2,2-dimethylpropanamide has a molecular weight of 422.49 g/mol, XLogP of 3.93, 5 rotatable bonds, 2 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]carbamoyl]-2,2-dimethylpropanamide is sourced from PubChem (CID 86269488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).