N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide

C23H26N6O2 — CID 46483596

IUPACN-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide
SMILESCCCn1c(=O)n(CCC(=O)Nc2ccc(-n3nc(C)cc3C)nc2)c2ccccc21
InChIInChI=1S/C23H26N6O2/c1-4-12-27-19-7-5-6-8-20(19)28(23(27)31)13-11-22(30)25-18-9-10-21(24-15-18)29-17(3)14-16(2)26-29/h5-10,14-15H,4,11-13H2,1-3H3,(H,25,30)
InChIKeyNQBUJCBCFUPXKP-UHFFFAOYSA-N
MW418.50 g/mol
LogP3.44
Rot. Bonds7

About N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide

N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide (PubChem CID 46483596) has the molecular formula C23H26N6O2 and a molecular weight of 418.50 g/mol. Its IUPAC name is N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide.

Molecular Properties

Compound NameN-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide
PubChem CID46483596
Molecular FormulaC23H26N6O2
Molecular Weight418.50 g/mol
Exact Mass418.21
IUPAC NameN-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide
SMILESCCCn1c(=O)n(CCC(=O)Nc2ccc(-n3nc(C)cc3C)nc2)c2ccccc21
InChIInChI=1S/C23H26N6O2/c1-4-12-27-19-7-5-6-8-20(19)28(23(27)31)13-11-22(30)25-18-9-10-21(24-15-18)29-17(3)14-16(2)26-29/h5-10,14-15H,4,11-13H2,1-3H3,(H,25,30)
InChIKeyNQBUJCBCFUPXKP-UHFFFAOYSA-N
XLogP3.44
TPSA86.74 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.50
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide with MolForge

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

Launch Full Analysis

Related Compounds

N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-2-(2-methylindol-1-yl)acetamide
CID 43064755
4-amino-N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]pentanamide;dihydrochloride
CID 120564625
N-[4-(carbamoylamino)phenyl]-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide
CID 33154220
N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-3-(furan-2-yl)propanamide
CID 43071070
N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-3-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)propanamide
CID 43071074
N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]pyridine-2-carboxamide
CID 38420472
6-(3,5-dimethylpyrazol-1-yl)-N-(6-methyl-3-pyridinyl)pyridine-3-carboxamide
CID 166228864
N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-2-(4-oxoquinazolin-3-yl)acetamide
CID 31908062
ethyl 4-[3-(2-oxo-3-propylbenzimidazol-1-yl)propanoylamino]benzoate
CID 27007290
N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-2-iodobenzamide
CID 31923974
N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-3-(2-nitroanilino)propanamide
CID 46436330
3,5-dichloro-N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]benzamide
CID 31923949

Frequently Asked Questions

What is the IUPAC name of N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide?
The IUPAC name of N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide (CID 46483596) is N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide.
What is the SMILES notation for N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide?
The canonical SMILES for N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide is CCCn1c(=O)n(CCC(=O)Nc2ccc(-n3nc(C)cc3C)nc2)c2ccccc21.
What is the InChIKey of N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide?
The InChIKey is NQBUJCBCFUPXKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N6O2/c1-4-12-27-19-7-5-6-8-20(19)28(23(27)31)13-11-22(30)25-18-9-10-21(24-15-18)29-17(3)14-16(2)26-29/h5-10,14-15H,4,11-13H2,1-3H3,(H,25,30).
What are the key properties of N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide?
N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide has a molecular weight of 418.50 g/mol, XLogP of 3.44, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide is sourced from PubChem (CID 46483596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).