1-cyclopentyl-3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]pyrazole

C20H24N4O — CID 78427294

IUPAC1-cyclopentyl-3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]pyrazole
SMILESCc1cc(COc2cc(C)nn2C2CCCC2)n(-c2ccccc2)n1
InChIInChI=1S/C20H24N4O/c1-15-12-19(23(21-15)17-8-4-3-5-9-17)14-25-20-13-16(2)22-24(20)18-10-6-7-11-18/h3-5,8-9,12-13,18H,6-7,10-11,14H2,1-2H3
InChIKeyAJGMDJIMOUFCCX-UHFFFAOYSA-N
MW336.44 g/mol
LogP4.38
Rot. Bonds5

About 1-cyclopentyl-3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]pyrazole

1-cyclopentyl-3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]pyrazole (PubChem CID 78427294) has the molecular formula C20H24N4O and a molecular weight of 336.44 g/mol. Its IUPAC name is 1-cyclopentyl-3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]pyrazole.

Molecular Properties

Compound Name1-cyclopentyl-3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]pyrazole
PubChem CID78427294
Molecular FormulaC20H24N4O
Molecular Weight336.44 g/mol
Exact Mass336.20
IUPAC Name1-cyclopentyl-3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]pyrazole
SMILESCc1cc(COc2cc(C)nn2C2CCCC2)n(-c2ccccc2)n1
InChIInChI=1S/C20H24N4O/c1-15-12-19(23(21-15)17-8-4-3-5-9-17)14-25-20-13-16(2)22-24(20)18-10-6-7-11-18/h3-5,8-9,12-13,18H,6-7,10-11,14H2,1-2H3
InChIKeyAJGMDJIMOUFCCX-UHFFFAOYSA-N
XLogP4.38
TPSA44.87 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]pyrazole?
The IUPAC name of 1-cyclopentyl-3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]pyrazole (CID 78427294) is 1-cyclopentyl-3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]pyrazole.
What is the SMILES notation for 1-cyclopentyl-3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]pyrazole?
The canonical SMILES for 1-cyclopentyl-3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]pyrazole is Cc1cc(COc2cc(C)nn2C2CCCC2)n(-c2ccccc2)n1.
What is the InChIKey of 1-cyclopentyl-3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]pyrazole?
The InChIKey is AJGMDJIMOUFCCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O/c1-15-12-19(23(21-15)17-8-4-3-5-9-17)14-25-20-13-16(2)22-24(20)18-10-6-7-11-18/h3-5,8-9,12-13,18H,6-7,10-11,14H2,1-2H3.
What are the key properties of 1-cyclopentyl-3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]pyrazole?
1-cyclopentyl-3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]pyrazole has a molecular weight of 336.44 g/mol, XLogP of 4.38, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-methyl-5-[(5-methyl-2-phenylpyrazol-3-yl)methoxy]pyrazole is sourced from PubChem (CID 78427294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).