N-ethyl-7-(1-ethyl-3-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

C15H18N6O — CID 19416589

IUPACN-ethyl-7-(1-ethyl-3-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCCNC(=O)c1cnn2c(-c3cn(CC)nc3C)ccnc12
InChIInChI=1S/C15H18N6O/c1-4-16-15(22)11-8-18-21-13(6-7-17-14(11)21)12-9-20(5-2)19-10(12)3/h6-9H,4-5H2,1-3H3,(H,16,22)
InChIKeyFESCXKBKZHEVTP-UHFFFAOYSA-N
MW298.35 g/mol
LogP1.67
Rot. Bonds4

About N-ethyl-7-(1-ethyl-3-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

N-ethyl-7-(1-ethyl-3-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 19416589) has the molecular formula C15H18N6O and a molecular weight of 298.35 g/mol. Its IUPAC name is N-ethyl-7-(1-ethyl-3-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-7-(1-ethyl-3-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID19416589
Molecular FormulaC15H18N6O
Molecular Weight298.35 g/mol
Exact Mass298.15
IUPAC NameN-ethyl-7-(1-ethyl-3-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCCNC(=O)c1cnn2c(-c3cn(CC)nc3C)ccnc12
InChIInChI=1S/C15H18N6O/c1-4-16-15(22)11-8-18-21-13(6-7-17-14(11)21)12-9-20(5-2)19-10(12)3/h6-9H,4-5H2,1-3H3,(H,16,22)
InChIKeyFESCXKBKZHEVTP-UHFFFAOYSA-N
XLogP1.67
TPSA77.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-7-(1-ethyl-3-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-ethyl-7-(1-ethyl-3-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 19416589) is N-ethyl-7-(1-ethyl-3-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-ethyl-7-(1-ethyl-3-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-ethyl-7-(1-ethyl-3-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is CCNC(=O)c1cnn2c(-c3cn(CC)nc3C)ccnc12.
What is the InChIKey of N-ethyl-7-(1-ethyl-3-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is FESCXKBKZHEVTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N6O/c1-4-16-15(22)11-8-18-21-13(6-7-17-14(11)21)12-9-20(5-2)19-10(12)3/h6-9H,4-5H2,1-3H3,(H,16,22).
What are the key properties of N-ethyl-7-(1-ethyl-3-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-ethyl-7-(1-ethyl-3-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 298.35 g/mol, XLogP of 1.67, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-7-(1-ethyl-3-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 19416589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).