N,N-diethyl-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide

C16H17N5O — CID 166249777

IUPACN,N-diethyl-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCCN(CC)C(=O)c1cnn2c(-c3cccnc3)ccnc12
InChIInChI=1S/C16H17N5O/c1-3-20(4-2)16(22)13-11-19-21-14(7-9-18-15(13)21)12-6-5-8-17-10-12/h5-11H,3-4H2,1-2H3
InChIKeyPOXFRKQKZVASHM-UHFFFAOYSA-N
MW295.35 g/mol
LogP2.27
Rot. Bonds4

About N,N-diethyl-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide

N,N-diethyl-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 166249777) has the molecular formula C16H17N5O and a molecular weight of 295.35 g/mol. Its IUPAC name is N,N-diethyl-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID166249777
Molecular FormulaC16H17N5O
Molecular Weight295.35 g/mol
Exact Mass295.14
IUPAC NameN,N-diethyl-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCCN(CC)C(=O)c1cnn2c(-c3cccnc3)ccnc12
InChIInChI=1S/C16H17N5O/c1-3-20(4-2)16(22)13-11-19-21-14(7-9-18-15(13)21)12-6-5-8-17-10-12/h5-11H,3-4H2,1-2H3
InChIKeyPOXFRKQKZVASHM-UHFFFAOYSA-N
XLogP2.27
TPSA63.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.35
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

7-(4-phenylphenyl)-N,N-dipropylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 42855352
N-[[4-(dimethylcarbamoyl)phenyl]methyl]-N-ethyl-7-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 56511044
7-(3-methoxyphenyl)-N,N-dipropylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 46050176
N-(2-cyclopropyl-2-hydroxypropyl)-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 126830270
2-ethyl-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 12766254
7-(4-fluorophenyl)-N,N-dipropylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 42855236
N,N-bis[(dimethylamino)methyl]-7-(3-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 67915903
3-chloro-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine
CID 11299190
ethyl 7-phenylpyrazolo[1,5-a]pyrimidine-3-carboxylate
CID 11230936
7-[3-[acetyl(ethyl)amino]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 46196965
3-(2-ethoxyethyl)-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine
CID 70569912
7-(3,4-dimethoxyphenyl)-N,N-dipropylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 42855278

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N,N-diethyl-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 166249777) is N,N-diethyl-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N,N-diethyl-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N,N-diethyl-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide is CCN(CC)C(=O)c1cnn2c(-c3cccnc3)ccnc12.
What is the InChIKey of N,N-diethyl-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is POXFRKQKZVASHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O/c1-3-20(4-2)16(22)13-11-19-21-14(7-9-18-15(13)21)12-6-5-8-17-10-12/h5-11H,3-4H2,1-2H3.
What are the key properties of N,N-diethyl-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
N,N-diethyl-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 295.35 g/mol, XLogP of 2.27, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 166249777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).