N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine

C18H24N6O — CID 56915887

IUPACN-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCC(C)c1cc(N(C)Cc2noc(C3CCCC3)n2)n2nccc2n1
InChIInChI=1S/C18H24N6O/c1-12(2)14-10-17(24-16(20-14)8-9-19-24)23(3)11-15-21-18(25-22-15)13-6-4-5-7-13/h8-10,12-13H,4-7,11H2,1-3H3
InChIKeyCBNMFPHMZYSZMA-UHFFFAOYSA-N
MW340.43 g/mol
LogP3.53
Rot. Bonds5

About N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine

N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 56915887) has the molecular formula C18H24N6O and a molecular weight of 340.43 g/mol. Its IUPAC name is N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound NameN-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID56915887
Molecular FormulaC18H24N6O
Molecular Weight340.43 g/mol
Exact Mass340.20
IUPAC NameN-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCC(C)c1cc(N(C)Cc2noc(C3CCCC3)n2)n2nccc2n1
InChIInChI=1S/C18H24N6O/c1-12(2)14-10-17(24-16(20-14)8-9-19-24)23(3)11-15-21-18(25-22-15)13-6-4-5-7-13/h8-10,12-13H,4-7,11H2,1-3H3
InChIKeyCBNMFPHMZYSZMA-UHFFFAOYSA-N
XLogP3.53
TPSA72.35 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine (CID 56915887) is N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine is CC(C)c1cc(N(C)Cc2noc(C3CCCC3)n2)n2nccc2n1.
What is the InChIKey of N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is CBNMFPHMZYSZMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N6O/c1-12(2)14-10-17(24-16(20-14)8-9-19-24)23(3)11-15-21-18(25-22-15)13-6-4-5-7-13/h8-10,12-13H,4-7,11H2,1-3H3.
What are the key properties of N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine?
N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 340.43 g/mol, XLogP of 3.53, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 56915887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).