5-(2-hydroxyethylamino)-N-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide

C15H15N5O2 — CID 66677577

IUPAC5-(2-hydroxyethylamino)-N-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESO=C(Nc1ccccc1)c1cnn2ccc(NCCO)nc12
InChIInChI=1S/C15H15N5O2/c21-9-7-16-13-6-8-20-14(19-13)12(10-17-20)15(22)18-11-4-2-1-3-5-11/h1-6,8,10,21H,7,9H2,(H,16,19)(H,18,22)
InChIKeyBBVJMPYMXLWDCE-UHFFFAOYSA-N
MW297.32 g/mol
LogP1.39
Rot. Bonds5

About 5-(2-hydroxyethylamino)-N-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide

5-(2-hydroxyethylamino)-N-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 66677577) has the molecular formula C15H15N5O2 and a molecular weight of 297.32 g/mol. Its IUPAC name is 5-(2-hydroxyethylamino)-N-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name5-(2-hydroxyethylamino)-N-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID66677577
Molecular FormulaC15H15N5O2
Molecular Weight297.32 g/mol
Exact Mass297.12
IUPAC Name5-(2-hydroxyethylamino)-N-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESO=C(Nc1ccccc1)c1cnn2ccc(NCCO)nc12
InChIInChI=1S/C15H15N5O2/c21-9-7-16-13-6-8-20-14(19-13)12(10-17-20)15(22)18-11-4-2-1-3-5-11/h1-6,8,10,21H,7,9H2,(H,16,19)(H,18,22)
InChIKeyBBVJMPYMXLWDCE-UHFFFAOYSA-N
XLogP1.39
TPSA91.55 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.32
LogP ≤ 51.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(2-hydroxyethylamino)-N-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 5-(2-hydroxyethylamino)-N-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 66677577) is 5-(2-hydroxyethylamino)-N-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 5-(2-hydroxyethylamino)-N-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 5-(2-hydroxyethylamino)-N-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide is O=C(Nc1ccccc1)c1cnn2ccc(NCCO)nc12.
What is the InChIKey of 5-(2-hydroxyethylamino)-N-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is BBVJMPYMXLWDCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O2/c21-9-7-16-13-6-8-20-14(19-13)12(10-17-20)15(22)18-11-4-2-1-3-5-11/h1-6,8,10,21H,7,9H2,(H,16,19)(H,18,22).
What are the key properties of 5-(2-hydroxyethylamino)-N-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
5-(2-hydroxyethylamino)-N-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 297.32 g/mol, XLogP of 1.39, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-hydroxyethylamino)-N-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 66677577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).