5,7-dimethyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

C15H18N6O — CID 110226468

IUPAC5,7-dimethyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cc(C)n2ncc(C(=O)NC(C)Cn3cccn3)c2n1
InChIInChI=1S/C15H18N6O/c1-10-7-12(3)21-14(18-10)13(8-17-21)15(22)19-11(2)9-20-6-4-5-16-20/h4-8,11H,9H2,1-3H3,(H,19,22)
InChIKeyTXLRYVIWEGHLNH-UHFFFAOYSA-N
MW298.35 g/mol
LogP1.36
Rot. Bonds4

About 5,7-dimethyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

5,7-dimethyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 110226468) has the molecular formula C15H18N6O and a molecular weight of 298.35 g/mol. Its IUPAC name is 5,7-dimethyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name5,7-dimethyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID110226468
Molecular FormulaC15H18N6O
Molecular Weight298.35 g/mol
Exact Mass298.15
IUPAC Name5,7-dimethyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cc(C)n2ncc(C(=O)NC(C)Cn3cccn3)c2n1
InChIInChI=1S/C15H18N6O/c1-10-7-12(3)21-14(18-10)13(8-17-21)15(22)19-11(2)9-20-6-4-5-16-20/h4-8,11H,9H2,1-3H3,(H,19,22)
InChIKeyTXLRYVIWEGHLNH-UHFFFAOYSA-N
XLogP1.36
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 ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5,7-dimethyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 5,7-dimethyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 110226468) is 5,7-dimethyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 5,7-dimethyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 5,7-dimethyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is Cc1cc(C)n2ncc(C(=O)NC(C)Cn3cccn3)c2n1.
What is the InChIKey of 5,7-dimethyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is TXLRYVIWEGHLNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N6O/c1-10-7-12(3)21-14(18-10)13(8-17-21)15(22)19-11(2)9-20-6-4-5-16-20/h4-8,11H,9H2,1-3H3,(H,19,22).
What are the key properties of 5,7-dimethyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
5,7-dimethyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 298.35 g/mol, XLogP of 1.36, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dimethyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 110226468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).