5-methyl-N-(3-methylphenyl)-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide

C22H22N6O2 — CID 53178992

IUPAC5-methyl-N-(3-methylphenyl)-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide
SMILESCCCc1noc(-c2ccnc(-n3ncc(C(=O)Nc4cccc(C)c4)c3C)c2)n1
InChIInChI=1S/C22H22N6O2/c1-4-6-19-26-22(30-27-19)16-9-10-23-20(12-16)28-15(3)18(13-24-28)21(29)25-17-8-5-7-14(2)11-17/h5,7-13H,4,6H2,1-3H3,(H,25,29)
InChIKeyDJQAKAHYIGFOHC-UHFFFAOYSA-N
MW402.46 g/mol
LogP4.14
Rot. Bonds6

About 5-methyl-N-(3-methylphenyl)-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide

5-methyl-N-(3-methylphenyl)-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide (PubChem CID 53178992) has the molecular formula C22H22N6O2 and a molecular weight of 402.46 g/mol. Its IUPAC name is 5-methyl-N-(3-methylphenyl)-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(3-methylphenyl)-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide
PubChem CID53178992
Molecular FormulaC22H22N6O2
Molecular Weight402.46 g/mol
Exact Mass402.18
IUPAC Name5-methyl-N-(3-methylphenyl)-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide
SMILESCCCc1noc(-c2ccnc(-n3ncc(C(=O)Nc4cccc(C)c4)c3C)c2)n1
InChIInChI=1S/C22H22N6O2/c1-4-6-19-26-22(30-27-19)16-9-10-23-20(12-16)28-15(3)18(13-24-28)21(29)25-17-8-5-7-14(2)11-17/h5,7-13H,4,6H2,1-3H3,(H,25,29)
InChIKeyDJQAKAHYIGFOHC-UHFFFAOYSA-N
XLogP4.14
TPSA98.73 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.46
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 5-methyl-N-(3-methylphenyl)-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide 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-(3-fluorophenyl)-5-methyl-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide
CID 53178994
3,4-dihydro-1H-isoquinolin-2-yl-[5-methyl-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazol-4-yl]methanone
CID 53179011
N-(cyclopropylmethyl)-1-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]-5-methylpyrazole-4-carboxamide
CID 53178980
N-(2-methoxyethyl)-5-methyl-1-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide
CID 53178953
N-(furan-2-ylmethyl)-5-methyl-1-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide
CID 53178948
N-cyclopropyl-5-methyl-1-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide
CID 53178942
[1-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]-5-methylpyrazol-4-yl]-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone
CID 53178987
5-ethyl-N-(3-methylphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide
CID 15944175
1-[4-(3-tert-butyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]-5-methylpyrazole-4-carboxylic acid
CID 56766811
N-(3-ethylphenyl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 15944134
1-[4-(3-tert-butyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]-N-(cyclopropylmethyl)-5-methylpyrazole-4-carboxamide
CID 53179048
N-[(4-methylphenyl)methyl]-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]imidazole-4-carboxamide
CID 53489920

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(3-methylphenyl)-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide?
The IUPAC name of 5-methyl-N-(3-methylphenyl)-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide (CID 53178992) is 5-methyl-N-(3-methylphenyl)-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide.
What is the SMILES notation for 5-methyl-N-(3-methylphenyl)-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide?
The canonical SMILES for 5-methyl-N-(3-methylphenyl)-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide is CCCc1noc(-c2ccnc(-n3ncc(C(=O)Nc4cccc(C)c4)c3C)c2)n1.
What is the InChIKey of 5-methyl-N-(3-methylphenyl)-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide?
The InChIKey is DJQAKAHYIGFOHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N6O2/c1-4-6-19-26-22(30-27-19)16-9-10-23-20(12-16)28-15(3)18(13-24-28)21(29)25-17-8-5-7-14(2)11-17/h5,7-13H,4,6H2,1-3H3,(H,25,29).
What are the key properties of 5-methyl-N-(3-methylphenyl)-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide?
5-methyl-N-(3-methylphenyl)-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide has a molecular weight of 402.46 g/mol, XLogP of 4.14, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(3-methylphenyl)-1-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide is sourced from PubChem (CID 53178992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).