3-cyclopentyl-N-(3-propan-2-ylpyrazolo[1,5-a]pyrimidin-2-yl)propanamide

C17H24N4O — CID 68750022

IUPAC3-cyclopentyl-N-(3-propan-2-ylpyrazolo[1,5-a]pyrimidin-2-yl)propanamide
SMILESCC(C)c1c(NC(=O)CCC2CCCC2)nn2cccnc12
InChIInChI=1S/C17H24N4O/c1-12(2)15-16(20-21-11-5-10-18-17(15)21)19-14(22)9-8-13-6-3-4-7-13/h5,10-13H,3-4,6-9H2,1-2H3,(H,19,20,22)
InChIKeyWDLCSOSXJNYRKE-UHFFFAOYSA-N
MW300.41 g/mol
LogP3.76
Rot. Bonds5

About 3-cyclopentyl-N-(3-propan-2-ylpyrazolo[1,5-a]pyrimidin-2-yl)propanamide

3-cyclopentyl-N-(3-propan-2-ylpyrazolo[1,5-a]pyrimidin-2-yl)propanamide (PubChem CID 68750022) has the molecular formula C17H24N4O and a molecular weight of 300.41 g/mol. Its IUPAC name is 3-cyclopentyl-N-(3-propan-2-ylpyrazolo[1,5-a]pyrimidin-2-yl)propanamide.

Molecular Properties

Compound Name3-cyclopentyl-N-(3-propan-2-ylpyrazolo[1,5-a]pyrimidin-2-yl)propanamide
PubChem CID68750022
Molecular FormulaC17H24N4O
Molecular Weight300.41 g/mol
Exact Mass300.20
IUPAC Name3-cyclopentyl-N-(3-propan-2-ylpyrazolo[1,5-a]pyrimidin-2-yl)propanamide
SMILESCC(C)c1c(NC(=O)CCC2CCCC2)nn2cccnc12
InChIInChI=1S/C17H24N4O/c1-12(2)15-16(20-21-11-5-10-18-17(15)21)19-14(22)9-8-13-6-3-4-7-13/h5,10-13H,3-4,6-9H2,1-2H3,(H,19,20,22)
InChIKeyWDLCSOSXJNYRKE-UHFFFAOYSA-N
XLogP3.76
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.41
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-(3-propan-2-ylpyrazolo[1,5-a]pyrimidin-2-yl)propanamide?
The IUPAC name of 3-cyclopentyl-N-(3-propan-2-ylpyrazolo[1,5-a]pyrimidin-2-yl)propanamide (CID 68750022) is 3-cyclopentyl-N-(3-propan-2-ylpyrazolo[1,5-a]pyrimidin-2-yl)propanamide.
What is the SMILES notation for 3-cyclopentyl-N-(3-propan-2-ylpyrazolo[1,5-a]pyrimidin-2-yl)propanamide?
The canonical SMILES for 3-cyclopentyl-N-(3-propan-2-ylpyrazolo[1,5-a]pyrimidin-2-yl)propanamide is CC(C)c1c(NC(=O)CCC2CCCC2)nn2cccnc12.
What is the InChIKey of 3-cyclopentyl-N-(3-propan-2-ylpyrazolo[1,5-a]pyrimidin-2-yl)propanamide?
The InChIKey is WDLCSOSXJNYRKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O/c1-12(2)15-16(20-21-11-5-10-18-17(15)21)19-14(22)9-8-13-6-3-4-7-13/h5,10-13H,3-4,6-9H2,1-2H3,(H,19,20,22).
What are the key properties of 3-cyclopentyl-N-(3-propan-2-ylpyrazolo[1,5-a]pyrimidin-2-yl)propanamide?
3-cyclopentyl-N-(3-propan-2-ylpyrazolo[1,5-a]pyrimidin-2-yl)propanamide has a molecular weight of 300.41 g/mol, XLogP of 3.76, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-(3-propan-2-ylpyrazolo[1,5-a]pyrimidin-2-yl)propanamide is sourced from PubChem (CID 68750022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).