1-(1-cyclopentylpyrazol-4-yl)-3-(8-methylimidazo[1,2-a]pyridin-6-yl)urea

C17H20N6O — CID 138054413

IUPAC1-(1-cyclopentylpyrazol-4-yl)-3-(8-methylimidazo[1,2-a]pyridin-6-yl)urea
SMILESCc1cc(NC(=O)Nc2cnn(C3CCCC3)c2)cn2ccnc12
InChIInChI=1S/C17H20N6O/c1-12-8-13(10-22-7-6-18-16(12)22)20-17(24)21-14-9-19-23(11-14)15-4-2-3-5-15/h6-11,15H,2-5H2,1H3,(H2,20,21,24)
InChIKeyDWFAHRRTTBZAAJ-UHFFFAOYSA-N
MW324.39 g/mol
LogP3.60
Rot. Bonds3

About 1-(1-cyclopentylpyrazol-4-yl)-3-(8-methylimidazo[1,2-a]pyridin-6-yl)urea

1-(1-cyclopentylpyrazol-4-yl)-3-(8-methylimidazo[1,2-a]pyridin-6-yl)urea (PubChem CID 138054413) has the molecular formula C17H20N6O and a molecular weight of 324.39 g/mol. Its IUPAC name is 1-(1-cyclopentylpyrazol-4-yl)-3-(8-methylimidazo[1,2-a]pyridin-6-yl)urea.

Molecular Properties

Compound Name1-(1-cyclopentylpyrazol-4-yl)-3-(8-methylimidazo[1,2-a]pyridin-6-yl)urea
PubChem CID138054413
Molecular FormulaC17H20N6O
Molecular Weight324.39 g/mol
Exact Mass324.17
IUPAC Name1-(1-cyclopentylpyrazol-4-yl)-3-(8-methylimidazo[1,2-a]pyridin-6-yl)urea
SMILESCc1cc(NC(=O)Nc2cnn(C3CCCC3)c2)cn2ccnc12
InChIInChI=1S/C17H20N6O/c1-12-8-13(10-22-7-6-18-16(12)22)20-17(24)21-14-9-19-23(11-14)15-4-2-3-5-15/h6-11,15H,2-5H2,1H3,(H2,20,21,24)
InChIKeyDWFAHRRTTBZAAJ-UHFFFAOYSA-N
XLogP3.60
TPSA76.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.39
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopentylpyrazol-4-yl)-3-(8-methylimidazo[1,2-a]pyridin-6-yl)urea?
The IUPAC name of 1-(1-cyclopentylpyrazol-4-yl)-3-(8-methylimidazo[1,2-a]pyridin-6-yl)urea (CID 138054413) is 1-(1-cyclopentylpyrazol-4-yl)-3-(8-methylimidazo[1,2-a]pyridin-6-yl)urea.
What is the SMILES notation for 1-(1-cyclopentylpyrazol-4-yl)-3-(8-methylimidazo[1,2-a]pyridin-6-yl)urea?
The canonical SMILES for 1-(1-cyclopentylpyrazol-4-yl)-3-(8-methylimidazo[1,2-a]pyridin-6-yl)urea is Cc1cc(NC(=O)Nc2cnn(C3CCCC3)c2)cn2ccnc12.
What is the InChIKey of 1-(1-cyclopentylpyrazol-4-yl)-3-(8-methylimidazo[1,2-a]pyridin-6-yl)urea?
The InChIKey is DWFAHRRTTBZAAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N6O/c1-12-8-13(10-22-7-6-18-16(12)22)20-17(24)21-14-9-19-23(11-14)15-4-2-3-5-15/h6-11,15H,2-5H2,1H3,(H2,20,21,24).
What are the key properties of 1-(1-cyclopentylpyrazol-4-yl)-3-(8-methylimidazo[1,2-a]pyridin-6-yl)urea?
1-(1-cyclopentylpyrazol-4-yl)-3-(8-methylimidazo[1,2-a]pyridin-6-yl)urea has a molecular weight of 324.39 g/mol, XLogP of 3.60, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopentylpyrazol-4-yl)-3-(8-methylimidazo[1,2-a]pyridin-6-yl)urea is sourced from PubChem (CID 138054413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).