2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[5-(4-propylphenyl)-1H-pyrazol-3-yl]acetamide

C19H23N5O — CID 126796562

IUPAC2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[5-(4-propylphenyl)-1H-pyrazol-3-yl]acetamide
SMILESCCCc1ccc(-c2cc(NC(=O)Cc3c(C)n[nH]c3C)n[nH]2)cc1
InChIInChI=1S/C19H23N5O/c1-4-5-14-6-8-15(9-7-14)17-11-18(24-23-17)20-19(25)10-16-12(2)21-22-13(16)3/h6-9,11H,4-5,10H2,1-3H3,(H,21,22)(H2,20,23,24,25)
InChIKeyMQDSRPPAVPJMPJ-UHFFFAOYSA-N
MW337.43 g/mol
LogP3.55
Rot. Bonds6

About 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[5-(4-propylphenyl)-1H-pyrazol-3-yl]acetamide

2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[5-(4-propylphenyl)-1H-pyrazol-3-yl]acetamide (PubChem CID 126796562) has the molecular formula C19H23N5O and a molecular weight of 337.43 g/mol. Its IUPAC name is 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[5-(4-propylphenyl)-1H-pyrazol-3-yl]acetamide.

Molecular Properties

Compound Name2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[5-(4-propylphenyl)-1H-pyrazol-3-yl]acetamide
PubChem CID126796562
Molecular FormulaC19H23N5O
Molecular Weight337.43 g/mol
Exact Mass337.19
IUPAC Name2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[5-(4-propylphenyl)-1H-pyrazol-3-yl]acetamide
SMILESCCCc1ccc(-c2cc(NC(=O)Cc3c(C)n[nH]c3C)n[nH]2)cc1
InChIInChI=1S/C19H23N5O/c1-4-5-14-6-8-15(9-7-14)17-11-18(24-23-17)20-19(25)10-16-12(2)21-22-13(16)3/h6-9,11H,4-5,10H2,1-3H3,(H,21,22)(H2,20,23,24,25)
InChIKeyMQDSRPPAVPJMPJ-UHFFFAOYSA-N
XLogP3.55
TPSA86.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.43
LogP ≤ 53.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[5-(4-propylphenyl)-1H-pyrazol-3-yl]acetamide?
The IUPAC name of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[5-(4-propylphenyl)-1H-pyrazol-3-yl]acetamide (CID 126796562) is 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[5-(4-propylphenyl)-1H-pyrazol-3-yl]acetamide.
What is the SMILES notation for 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[5-(4-propylphenyl)-1H-pyrazol-3-yl]acetamide?
The canonical SMILES for 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[5-(4-propylphenyl)-1H-pyrazol-3-yl]acetamide is CCCc1ccc(-c2cc(NC(=O)Cc3c(C)n[nH]c3C)n[nH]2)cc1.
What is the InChIKey of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[5-(4-propylphenyl)-1H-pyrazol-3-yl]acetamide?
The InChIKey is MQDSRPPAVPJMPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O/c1-4-5-14-6-8-15(9-7-14)17-11-18(24-23-17)20-19(25)10-16-12(2)21-22-13(16)3/h6-9,11H,4-5,10H2,1-3H3,(H,21,22)(H2,20,23,24,25).
What are the key properties of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[5-(4-propylphenyl)-1H-pyrazol-3-yl]acetamide?
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[5-(4-propylphenyl)-1H-pyrazol-3-yl]acetamide has a molecular weight of 337.43 g/mol, XLogP of 3.55, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[5-(4-propylphenyl)-1H-pyrazol-3-yl]acetamide is sourced from PubChem (CID 126796562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).