N-[(5-methyl-1,2-oxazol-3-yl)methyl]-5-propylpyrazolo[1,5-a]pyrimidin-7-amine

C14H17N5O — CID 56898648

IUPACN-[(5-methyl-1,2-oxazol-3-yl)methyl]-5-propylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCCc1cc(NCc2cc(C)on2)n2nccc2n1
InChIInChI=1S/C14H17N5O/c1-3-4-11-8-14(19-13(17-11)5-6-16-19)15-9-12-7-10(2)20-18-12/h5-8,15H,3-4,9H2,1-2H3
InChIKeyGBPHYUIBLZJRRH-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.59
Rot. Bonds5

About N-[(5-methyl-1,2-oxazol-3-yl)methyl]-5-propylpyrazolo[1,5-a]pyrimidin-7-amine

N-[(5-methyl-1,2-oxazol-3-yl)methyl]-5-propylpyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 56898648) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is N-[(5-methyl-1,2-oxazol-3-yl)methyl]-5-propylpyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound NameN-[(5-methyl-1,2-oxazol-3-yl)methyl]-5-propylpyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID56898648
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC NameN-[(5-methyl-1,2-oxazol-3-yl)methyl]-5-propylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCCc1cc(NCc2cc(C)on2)n2nccc2n1
InChIInChI=1S/C14H17N5O/c1-3-4-11-8-14(19-13(17-11)5-6-16-19)15-9-12-7-10(2)20-18-12/h5-8,15H,3-4,9H2,1-2H3
InChIKeyGBPHYUIBLZJRRH-UHFFFAOYSA-N
XLogP2.59
TPSA68.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[(5-methyl-1,2-oxazol-3-yl)methyl]-5-propylpyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of N-[(5-methyl-1,2-oxazol-3-yl)methyl]-5-propylpyrazolo[1,5-a]pyrimidin-7-amine (CID 56898648) is N-[(5-methyl-1,2-oxazol-3-yl)methyl]-5-propylpyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for N-[(5-methyl-1,2-oxazol-3-yl)methyl]-5-propylpyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for N-[(5-methyl-1,2-oxazol-3-yl)methyl]-5-propylpyrazolo[1,5-a]pyrimidin-7-amine is CCCc1cc(NCc2cc(C)on2)n2nccc2n1.
What is the InChIKey of N-[(5-methyl-1,2-oxazol-3-yl)methyl]-5-propylpyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is GBPHYUIBLZJRRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c1-3-4-11-8-14(19-13(17-11)5-6-16-19)15-9-12-7-10(2)20-18-12/h5-8,15H,3-4,9H2,1-2H3.
What are the key properties of N-[(5-methyl-1,2-oxazol-3-yl)methyl]-5-propylpyrazolo[1,5-a]pyrimidin-7-amine?
N-[(5-methyl-1,2-oxazol-3-yl)methyl]-5-propylpyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 271.32 g/mol, XLogP of 2.59, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyl-1,2-oxazol-3-yl)methyl]-5-propylpyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 56898648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).