2-[4-(4-methylphenoxy)phenyl]-7-piperidin-4-yl-5H-imidazo[1,2-b]pyrazole-3-carboxamide

C24H25N5O2 — CID 166949371

IUPAC2-[4-(4-methylphenoxy)phenyl]-7-piperidin-4-yl-5H-imidazo[1,2-b]pyrazole-3-carboxamide
SMILESCc1ccc(Oc2ccc(-c3nc4c(C5CCNCC5)c[nH]n4c3C(N)=O)cc2)cc1
InChIInChI=1S/C24H25N5O2/c1-15-2-6-18(7-3-15)31-19-8-4-17(5-9-19)21-22(23(25)30)29-24(28-21)20(14-27-29)16-10-12-26-13-11-16/h2-9,14,16,26-27H,10-13H2,1H3,(H2,25,30)
InChIKeyHDYQUUZTGJBPSF-UHFFFAOYSA-N
MW415.50 g/mol
LogP4.00
Rot. Bonds5

About 2-[4-(4-methylphenoxy)phenyl]-7-piperidin-4-yl-5H-imidazo[1,2-b]pyrazole-3-carboxamide

2-[4-(4-methylphenoxy)phenyl]-7-piperidin-4-yl-5H-imidazo[1,2-b]pyrazole-3-carboxamide (PubChem CID 166949371) has the molecular formula C24H25N5O2 and a molecular weight of 415.50 g/mol. Its IUPAC name is 2-[4-(4-methylphenoxy)phenyl]-7-piperidin-4-yl-5H-imidazo[1,2-b]pyrazole-3-carboxamide.

Molecular Properties

Compound Name2-[4-(4-methylphenoxy)phenyl]-7-piperidin-4-yl-5H-imidazo[1,2-b]pyrazole-3-carboxamide
PubChem CID166949371
Molecular FormulaC24H25N5O2
Molecular Weight415.50 g/mol
Exact Mass415.20
IUPAC Name2-[4-(4-methylphenoxy)phenyl]-7-piperidin-4-yl-5H-imidazo[1,2-b]pyrazole-3-carboxamide
SMILESCc1ccc(Oc2ccc(-c3nc4c(C5CCNCC5)c[nH]n4c3C(N)=O)cc2)cc1
InChIInChI=1S/C24H25N5O2/c1-15-2-6-18(7-3-15)31-19-8-4-17(5-9-19)21-22(23(25)30)29-24(28-21)20(14-27-29)16-10-12-26-13-11-16/h2-9,14,16,26-27H,10-13H2,1H3,(H2,25,30)
InChIKeyHDYQUUZTGJBPSF-UHFFFAOYSA-N
XLogP4.00
TPSA97.44 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.50
LogP ≤ 54.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-methylphenoxy)phenyl]-7-piperidin-4-yl-5H-imidazo[1,2-b]pyrazole-3-carboxamide?
The IUPAC name of 2-[4-(4-methylphenoxy)phenyl]-7-piperidin-4-yl-5H-imidazo[1,2-b]pyrazole-3-carboxamide (CID 166949371) is 2-[4-(4-methylphenoxy)phenyl]-7-piperidin-4-yl-5H-imidazo[1,2-b]pyrazole-3-carboxamide.
What is the SMILES notation for 2-[4-(4-methylphenoxy)phenyl]-7-piperidin-4-yl-5H-imidazo[1,2-b]pyrazole-3-carboxamide?
The canonical SMILES for 2-[4-(4-methylphenoxy)phenyl]-7-piperidin-4-yl-5H-imidazo[1,2-b]pyrazole-3-carboxamide is Cc1ccc(Oc2ccc(-c3nc4c(C5CCNCC5)c[nH]n4c3C(N)=O)cc2)cc1.
What is the InChIKey of 2-[4-(4-methylphenoxy)phenyl]-7-piperidin-4-yl-5H-imidazo[1,2-b]pyrazole-3-carboxamide?
The InChIKey is HDYQUUZTGJBPSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N5O2/c1-15-2-6-18(7-3-15)31-19-8-4-17(5-9-19)21-22(23(25)30)29-24(28-21)20(14-27-29)16-10-12-26-13-11-16/h2-9,14,16,26-27H,10-13H2,1H3,(H2,25,30).
What are the key properties of 2-[4-(4-methylphenoxy)phenyl]-7-piperidin-4-yl-5H-imidazo[1,2-b]pyrazole-3-carboxamide?
2-[4-(4-methylphenoxy)phenyl]-7-piperidin-4-yl-5H-imidazo[1,2-b]pyrazole-3-carboxamide has a molecular weight of 415.50 g/mol, XLogP of 4.00, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-methylphenoxy)phenyl]-7-piperidin-4-yl-5H-imidazo[1,2-b]pyrazole-3-carboxamide is sourced from PubChem (CID 166949371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).