5-methyl-N-[2-(6-methylimidazo[1,2-b]pyrazol-1-yl)ethyl]-1-phenylpyrazole-4-carboxamide

C19H20N6O — CID 91629216

IUPAC5-methyl-N-[2-(6-methylimidazo[1,2-b]pyrazol-1-yl)ethyl]-1-phenylpyrazole-4-carboxamide
SMILESCc1cc2n(CCNC(=O)c3cnn(-c4ccccc4)c3C)ccn2n1
InChIInChI=1S/C19H20N6O/c1-14-12-18-23(10-11-24(18)22-14)9-8-20-19(26)17-13-21-25(15(17)2)16-6-4-3-5-7-16/h3-7,10-13H,8-9H2,1-2H3,(H,20,26)
InChIKeyKSAYKPDAMDAXNK-UHFFFAOYSA-N
MW348.41 g/mol
LogP2.37
Rot. Bonds5

About 5-methyl-N-[2-(6-methylimidazo[1,2-b]pyrazol-1-yl)ethyl]-1-phenylpyrazole-4-carboxamide

5-methyl-N-[2-(6-methylimidazo[1,2-b]pyrazol-1-yl)ethyl]-1-phenylpyrazole-4-carboxamide (PubChem CID 91629216) has the molecular formula C19H20N6O and a molecular weight of 348.41 g/mol. Its IUPAC name is 5-methyl-N-[2-(6-methylimidazo[1,2-b]pyrazol-1-yl)ethyl]-1-phenylpyrazole-4-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[2-(6-methylimidazo[1,2-b]pyrazol-1-yl)ethyl]-1-phenylpyrazole-4-carboxamide
PubChem CID91629216
Molecular FormulaC19H20N6O
Molecular Weight348.41 g/mol
Exact Mass348.17
IUPAC Name5-methyl-N-[2-(6-methylimidazo[1,2-b]pyrazol-1-yl)ethyl]-1-phenylpyrazole-4-carboxamide
SMILESCc1cc2n(CCNC(=O)c3cnn(-c4ccccc4)c3C)ccn2n1
InChIInChI=1S/C19H20N6O/c1-14-12-18-23(10-11-24(18)22-14)9-8-20-19(26)17-13-21-25(15(17)2)16-6-4-3-5-7-16/h3-7,10-13H,8-9H2,1-2H3,(H,20,26)
InChIKeyKSAYKPDAMDAXNK-UHFFFAOYSA-N
XLogP2.37
TPSA69.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.41
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[2-(6-methylimidazo[1,2-b]pyrazol-1-yl)ethyl]-1-phenylpyrazole-4-carboxamide?
The IUPAC name of 5-methyl-N-[2-(6-methylimidazo[1,2-b]pyrazol-1-yl)ethyl]-1-phenylpyrazole-4-carboxamide (CID 91629216) is 5-methyl-N-[2-(6-methylimidazo[1,2-b]pyrazol-1-yl)ethyl]-1-phenylpyrazole-4-carboxamide.
What is the SMILES notation for 5-methyl-N-[2-(6-methylimidazo[1,2-b]pyrazol-1-yl)ethyl]-1-phenylpyrazole-4-carboxamide?
The canonical SMILES for 5-methyl-N-[2-(6-methylimidazo[1,2-b]pyrazol-1-yl)ethyl]-1-phenylpyrazole-4-carboxamide is Cc1cc2n(CCNC(=O)c3cnn(-c4ccccc4)c3C)ccn2n1.
What is the InChIKey of 5-methyl-N-[2-(6-methylimidazo[1,2-b]pyrazol-1-yl)ethyl]-1-phenylpyrazole-4-carboxamide?
The InChIKey is KSAYKPDAMDAXNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6O/c1-14-12-18-23(10-11-24(18)22-14)9-8-20-19(26)17-13-21-25(15(17)2)16-6-4-3-5-7-16/h3-7,10-13H,8-9H2,1-2H3,(H,20,26).
What are the key properties of 5-methyl-N-[2-(6-methylimidazo[1,2-b]pyrazol-1-yl)ethyl]-1-phenylpyrazole-4-carboxamide?
5-methyl-N-[2-(6-methylimidazo[1,2-b]pyrazol-1-yl)ethyl]-1-phenylpyrazole-4-carboxamide has a molecular weight of 348.41 g/mol, XLogP of 2.37, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[2-(6-methylimidazo[1,2-b]pyrazol-1-yl)ethyl]-1-phenylpyrazole-4-carboxamide is sourced from PubChem (CID 91629216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).