5-ethyl-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine

C14H15N5 — CID 56890779

IUPAC5-ethyl-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCc1cc(NCc2ccncc2)n2nccc2n1
InChIInChI=1S/C14H15N5/c1-2-12-9-14(19-13(18-12)5-8-17-19)16-10-11-3-6-15-7-4-11/h3-9,16H,2,10H2,1H3
InChIKeyJHKPKPGSBQZWAK-UHFFFAOYSA-N
MW253.31 g/mol
LogP2.30
Rot. Bonds4

About 5-ethyl-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine

5-ethyl-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 56890779) has the molecular formula C14H15N5 and a molecular weight of 253.31 g/mol. Its IUPAC name is 5-ethyl-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-ethyl-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID56890779
Molecular FormulaC14H15N5
Molecular Weight253.31 g/mol
Exact Mass253.13
IUPAC Name5-ethyl-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCc1cc(NCc2ccncc2)n2nccc2n1
InChIInChI=1S/C14H15N5/c1-2-12-9-14(19-13(18-12)5-8-17-19)16-10-11-3-6-15-7-4-11/h3-9,16H,2,10H2,1H3
InChIKeyJHKPKPGSBQZWAK-UHFFFAOYSA-N
XLogP2.30
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-ethyl-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine (CID 56890779) is 5-ethyl-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-ethyl-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-ethyl-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine is CCc1cc(NCc2ccncc2)n2nccc2n1.
What is the InChIKey of 5-ethyl-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is JHKPKPGSBQZWAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5/c1-2-12-9-14(19-13(18-12)5-8-17-19)16-10-11-3-6-15-7-4-11/h3-9,16H,2,10H2,1H3.
What are the key properties of 5-ethyl-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
5-ethyl-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 253.31 g/mol, XLogP of 2.30, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 56890779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).