7-ethyl-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide

C16H16N4O2 — CID 53040789

IUPAC7-ethyl-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESCCc1cc(C(=O)Nc2cccc(OC)c2)nc2ccnn12
InChIInChI=1S/C16H16N4O2/c1-3-12-10-14(19-15-7-8-17-20(12)15)16(21)18-11-5-4-6-13(9-11)22-2/h4-10H,3H2,1-2H3,(H,18,21)
InChIKeyLFKPYMBBGAEXRP-UHFFFAOYSA-N
MW296.33 g/mol
LogP2.55
Rot. Bonds4

About 7-ethyl-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide

7-ethyl-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide (PubChem CID 53040789) has the molecular formula C16H16N4O2 and a molecular weight of 296.33 g/mol. Its IUPAC name is 7-ethyl-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide.

Molecular Properties

Compound Name7-ethyl-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide
PubChem CID53040789
Molecular FormulaC16H16N4O2
Molecular Weight296.33 g/mol
Exact Mass296.13
IUPAC Name7-ethyl-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESCCc1cc(C(=O)Nc2cccc(OC)c2)nc2ccnn12
InChIInChI=1S/C16H16N4O2/c1-3-12-10-14(19-15-7-8-17-20(12)15)16(21)18-11-5-4-6-13(9-11)22-2/h4-10H,3H2,1-2H3,(H,18,21)
InChIKeyLFKPYMBBGAEXRP-UHFFFAOYSA-N
XLogP2.55
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-ethyl-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide?
The IUPAC name of 7-ethyl-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide (CID 53040789) is 7-ethyl-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide.
What is the SMILES notation for 7-ethyl-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide?
The canonical SMILES for 7-ethyl-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide is CCc1cc(C(=O)Nc2cccc(OC)c2)nc2ccnn12.
What is the InChIKey of 7-ethyl-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide?
The InChIKey is LFKPYMBBGAEXRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O2/c1-3-12-10-14(19-15-7-8-17-20(12)15)16(21)18-11-5-4-6-13(9-11)22-2/h4-10H,3H2,1-2H3,(H,18,21).
What are the key properties of 7-ethyl-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide?
7-ethyl-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide has a molecular weight of 296.33 g/mol, XLogP of 2.55, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide is sourced from PubChem (CID 53040789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).