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

C20H24N4O2 — CID 46050176

IUPAC7-(3-methoxyphenyl)-N,N-dipropylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCCCN(CCC)C(=O)c1cnn2c(-c3cccc(OC)c3)ccnc12
InChIInChI=1S/C20H24N4O2/c1-4-11-23(12-5-2)20(25)17-14-22-24-18(9-10-21-19(17)24)15-7-6-8-16(13-15)26-3/h6-10,13-14H,4-5,11-12H2,1-3H3
InChIKeyVEEAPOWMDKIBQU-UHFFFAOYSA-N
MW352.44 g/mol
LogP3.67
Rot. Bonds7

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

7-(3-methoxyphenyl)-N,N-dipropylpyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 46050176) has the molecular formula C20H24N4O2 and a molecular weight of 352.44 g/mol. Its IUPAC name is 7-(3-methoxyphenyl)-N,N-dipropylpyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name7-(3-methoxyphenyl)-N,N-dipropylpyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID46050176
Molecular FormulaC20H24N4O2
Molecular Weight352.44 g/mol
Exact Mass352.19
IUPAC Name7-(3-methoxyphenyl)-N,N-dipropylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCCCN(CCC)C(=O)c1cnn2c(-c3cccc(OC)c3)ccnc12
InChIInChI=1S/C20H24N4O2/c1-4-11-23(12-5-2)20(25)17-14-22-24-18(9-10-21-19(17)24)15-7-6-8-16(13-15)26-3/h6-10,13-14H,4-5,11-12H2,1-3H3
InChIKeyVEEAPOWMDKIBQU-UHFFFAOYSA-N
XLogP3.67
TPSA59.73 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-(3-methoxyphenyl)-N,N-dipropylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 7-(3-methoxyphenyl)-N,N-dipropylpyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 46050176) is 7-(3-methoxyphenyl)-N,N-dipropylpyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 7-(3-methoxyphenyl)-N,N-dipropylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 7-(3-methoxyphenyl)-N,N-dipropylpyrazolo[1,5-a]pyrimidine-3-carboxamide is CCCN(CCC)C(=O)c1cnn2c(-c3cccc(OC)c3)ccnc12.
What is the InChIKey of 7-(3-methoxyphenyl)-N,N-dipropylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is VEEAPOWMDKIBQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O2/c1-4-11-23(12-5-2)20(25)17-14-22-24-18(9-10-21-19(17)24)15-7-6-8-16(13-15)26-3/h6-10,13-14H,4-5,11-12H2,1-3H3.
What are the key properties of 7-(3-methoxyphenyl)-N,N-dipropylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
7-(3-methoxyphenyl)-N,N-dipropylpyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 352.44 g/mol, XLogP of 3.67, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3-methoxyphenyl)-N,N-dipropylpyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 46050176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).